
     RDKit          2D

 12 13  0  0  0  0  0  0  0  0999 V2000
    3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2135    2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6401    3.1891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    3.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2135    2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2418    1.4558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  6
 11  2  1  0
 11  6  1  0
M  END
>  <DATASOURCE_REGID>  (1) 
UALIB-1868

>  <SMILES_RDKIT_2019.09.2>  (1) 
C[C@@H]1CCCN2C(=O)CC[C@@]12O

>  <INCHI_1.05_RDKIT_2019.09.2>  (1) 
InChI=1S/C9H15NO2/c1-7-3-2-6-10-8(11)4-5-9(7,10)12/h7,12H,2-6H2,1H3/t7-,9-/m1/s1

>  <SUBSTANCE_COMMENT>  (1) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (1) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 11 12  0  0  0  0  0  0  0  0999 V2000
    2.7760    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2760    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943    1.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323   -0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9140   -1.9635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4140   -1.9635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323   -3.1771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943   -2.7135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943   -1.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8209   -1.6771    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  1
 10  2  1  0
 10  5  1  0
M  END
>  <DATASOURCE_REGID>  (2) 
UALIB-1869

>  <SMILES_RDKIT_2019.09.2>  (2) 
C[C@@H]1CCN2C(=O)CC[C@@]12O

>  <INCHI_1.05_RDKIT_2019.09.2>  (2) 
InChI=1S/C8H13NO2/c1-6-3-5-9-7(10)2-4-8(6,9)11/h6,11H,2-5H2,1H3/t6-,8-/m1/s1

>  <SUBSTANCE_COMMENT>  (2) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (2) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 13 14  0  0  0  0  0  0  0  0999 V2000
    3.7500   -1.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2135    2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6401    3.1891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    3.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2135    2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2418    1.4558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  3  2  1  6
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  6
 12  3  1  0
 12  7  1  0
M  END
>  <DATASOURCE_REGID>  (3) 
UALIB-1870

>  <SMILES_RDKIT_2019.09.2>  (3) 
O=C1CC[C@@]2(O)[C@H](CO)CCCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (3) 
InChI=1S/C9H15NO3/c11-6-7-2-1-5-10-8(12)3-4-9(7,10)13/h7,11,13H,1-6H2/t7-,9+/m0/s1

>  <SUBSTANCE_COMMENT>  (3) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (3) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 12 13  0  0  0  0  0  0  0  0999 V2000
    3.5260   -1.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7760    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2760    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943    1.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323   -0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9140   -1.9635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4140   -1.9635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323   -3.1771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943   -2.7135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943   -1.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8209   -1.6771    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  3  2  1  1
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  1
 11  3  1  0
 11  6  1  0
M  END
>  <DATASOURCE_REGID>  (4) 
UALIB-1871

>  <SMILES_RDKIT_2019.09.2>  (4) 
O=C1CC[C@@]2(O)[C@H](CO)CCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (4) 
InChI=1S/C8H13NO3/c10-5-6-2-4-9-7(11)1-3-8(6,9)12/h6,10,12H,1-5H2/t6-,8+/m0/s1

>  <SUBSTANCE_COMMENT>  (4) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (4) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 23 24  0  0  0  0  0  0  0  0999 V2000
    6.5490   -3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2500   -2.7990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9510   -3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2500   -1.2990    0.0000 Si  0  0  0  0  0  4  0  0  0  0  0  0
    3.7500   -1.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2135    2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0000    3.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2135    2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2500    0.2010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5490    0.9510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9510    0.9510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5000   -2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  7  6  1  6
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  6
  4 18  1  0
 18 19  1  0
 18 20  1  0
  4 21  1  0
 21 22  1  0
 21 23  1  0
 16  7  1  0
 16 11  1  0
M  END
>  <DATASOURCE_REGID>  (5) 
UALIB-1872

>  <SMILES_RDKIT_2019.09.2>  (5) 
CC(C)[Si](OC[C@@H]1CCCN2C(=O)CC[C@@]12O)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (5) 
InChI=1S/C18H35NO3Si/c1-13(2)23(14(3)4,15(5)6)22-12-16-8-7-11-19-17(20)9-10-18(16,19)21/h13-16,21H,7-12H2,1-6H3/t16-,18+/m0/s1

>  <SUBSTANCE_COMMENT>  (5) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (5) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 22 23  0  0  0  0  0  0  0  0999 V2000
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2135   -2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2135   -2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6401   -3.1891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7500    1.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2500    1.2990    0.0000 Si  0  0  0  0  0  4  0  0  0  0  0  0
   -5.2500    2.7990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5490    3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9510    3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2500   -0.2010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5490   -0.9510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9510   -0.9510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5000    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  1
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  6
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 14 16  1  0
 13 17  1  0
 17 18  1  0
 17 19  1  0
 13 20  1  0
 20 21  1  0
 20 22  1  0
  6  1  1  0
 10  1  1  0
M  END
>  <DATASOURCE_REGID>  (6) 
UALIB-1873

>  <SMILES_RDKIT_2019.09.2>  (6) 
CC(C)[Si](OC[C@@H]1CCCN2C(=O)CC[C@@H]12)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (6) 
InChI=1S/C18H35NO2Si/c1-13(2)22(14(3)4,15(5)6)21-12-16-8-7-11-19-17(16)9-10-18(19)20/h13-17H,7-12H2,1-6H3/t16-,17-/m0/s1

>  <SUBSTANCE_COMMENT>  (6) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (6) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 10 11  0  0  0  0  0  0  0  0999 V2000
    0.3943    1.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2760    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943   -1.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2458   -1.6317    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323    0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9140    1.9635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323    3.1771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3943    2.7135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6078    3.5952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  6
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  6
  6  1  1  0
  9  1  1  0
M  END
>  <DATASOURCE_REGID>  (7) 
UALIB-1874

>  <SMILES_RDKIT_2019.09.2>  (7) 
C[C@H]1CCN2C(=O)CC[C@@H]12

>  <INCHI_1.05_RDKIT_2019.09.2>  (7) 
InChI=1S/C8H13NO/c1-6-4-5-9-7(6)2-3-8(9)10/h6-7H,2-5H2,1H3/t6-,7-/m0/s1

>  <SUBSTANCE_COMMENT>  (7) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (7) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 11 12  0  0  0  0  0  0  0  0999 V2000
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2135   -2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2135   -2.7256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  9 10  1  0
 10 11  1  1
  6  1  1  0
 10  1  1  0
M  END
>  <DATASOURCE_REGID>  (8) 
UALIB-1875

>  <SMILES_RDKIT_2019.09.2>  (8) 
C[C@H]1CCCN2C(=O)CC[C@@H]12

>  <INCHI_1.05_RDKIT_2019.09.2>  (8) 
InChI=1S/C9H15NO/c1-7-3-2-6-10-8(7)4-5-9(10)11/h7-8H,2-6H2,1H3/t7-,8-/m0/s1

>  <SUBSTANCE_COMMENT>  (8) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (8) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 12 13  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <DATASOURCE_REGID>  (9) 
UALIB-1876

>  <SMILES_RDKIT_2019.09.2>  (9) 
CC[C@H]1CCCN2C(=O)CC[C@@H]12

>  <INCHI_1.05_RDKIT_2019.09.2>  (9) 
InChI=1S/C10H17NO/c1-2-8-4-3-7-11-9(8)5-6-10(11)12/h8-9H,2-7H2,1H3/t8-,9-/m0/s1

>  <SUBSTANCE_COMMENT>  (9) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (9) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 12 13  0  0  0  0  0  0  0  0999 V2000
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   -0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7500    1.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <DATASOURCE_REGID>  (10) 
UALIB-1877

>  <SMILES_RDKIT_2019.09.2>  (10) 
O=C1CC[C@H]2[C@@H](CO)CCCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (10) 
InChI=1S/C9H15NO2/c11-6-7-2-1-5-10-8(7)3-4-9(10)12/h7-8,11H,1-6H2/t7-,8+/m1/s1

>  <SUBSTANCE_COMMENT>  (10) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (10) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 12 13  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <DATASOURCE_REGID>  (11) 
UALIB-1878

>  <SMILES_RDKIT_2019.09.2>  (11) 
O=C1CC[C@H]2[C@H](CO)CCCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (11) 
InChI=1S/C9H15NO2/c11-6-7-2-1-5-10-8(7)3-4-9(10)12/h7-8,11H,1-6H2/t7-,8-/m0/s1

>  <SUBSTANCE_COMMENT>  (11) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (11) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 10 11  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  6
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M  END
>  <DATASOURCE_REGID>  (12) 
UALIB-1879

>  <SMILES_RDKIT_2019.09.2>  (12) 
C[C@@H]1CCN2C(=O)CC[C@@H]12

>  <INCHI_1.05_RDKIT_2019.09.2>  (12) 
InChI=1S/C8H13NO/c1-6-4-5-9-7(6)2-3-8(9)10/h6-7H,2-5H2,1H3/t6-,7+/m1/s1

>  <SUBSTANCE_COMMENT>  (12) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (12) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 11 12  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <DATASOURCE_REGID>  (13) 
UALIB-1880

>  <SMILES_RDKIT_2019.09.2>  (13) 
C[C@@H]1CCCN2C(=O)CC[C@@H]12

>  <INCHI_1.05_RDKIT_2019.09.2>  (13) 
InChI=1S/C9H15NO/c1-7-3-2-6-10-8(7)4-5-9(10)11/h7-8H,2-6H2,1H3/t7-,8+/m1/s1

>  <SUBSTANCE_COMMENT>  (13) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (13) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 11 12  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <DATASOURCE_REGID>  (14) 
UALIB-1881

>  <SMILES_RDKIT_2019.09.2>  (14) 
O=C1CC[C@H]2[C@H](CO)CCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (14) 
InChI=1S/C8H13NO2/c10-5-6-3-4-9-7(6)1-2-8(9)11/h6-7,10H,1-5H2/t6-,7-/m0/s1

>  <SUBSTANCE_COMMENT>  (14) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (14) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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  1  2  1  6
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M  END
>  <DATASOURCE_REGID>  (15) 
UALIB-1882

>  <SMILES_RDKIT_2019.09.2>  (15) 
CC(C)[Si](OC[C@@H]1CCCN2CCC[C@@H]12)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (15) 
InChI=1S/C18H37NOSi/c1-14(2)21(15(3)4,16(5)6)20-13-17-9-7-11-19-12-8-10-18(17)19/h14-18H,7-13H2,1-6H3/t17-,18-/m0/s1

>  <SUBSTANCE_COMMENT>  (15) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (15) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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  1  2  1  0
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 18 19  2  0
 18 20  1  0
 20 21  1  0
M  END
>  <DATASOURCE_REGID>  (16) 
UALIB-1883

>  <SMILES_RDKIT_2019.09.2>  (16) 
COC(=O)C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)C(=O)OC

>  <INCHI_1.05_RDKIT_2019.09.2>  (16) 
InChI=1S/C15H30O5Si/c1-10(2)21(11(3)4,12(5)6)20-13(15(17)19-8)9-14(16)18-7/h10-13H,9H2,1-8H3/t13-/m0/s1

>  <SUBSTANCE_COMMENT>  (16) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (16) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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    3.5260   -3.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 13 15  1  0
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 16 17  1  0
 16 18  1  0
 11  6  1  0
M  END
>  <DATASOURCE_REGID>  (17) 
UALIB-1884

>  <SMILES_RDKIT_2019.09.2>  (17) 
CC(C)[Si](O[C@H]1CC(=O)NC1=O)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (17) 
InChI=1S/C13H25NO3Si/c1-8(2)18(9(3)4,10(5)6)17-11-7-12(15)14-13(11)16/h8-11H,7H2,1-6H3,(H,14,15,16)/t11-/m0/s1

>  <SUBSTANCE_COMMENT>  (17) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (17) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 22 22  0  0  0  0  0  0  0  0999 V2000
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    2.2269   -3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0
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 13 14  2  0
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 17 18  1  0
 17 19  1  0
  4 20  1  0
 20 21  1  0
 20 22  1  0
 15  6  1  0
M  END
>  <DATASOURCE_REGID>  (18) 
UALIB-1885

>  <SMILES_RDKIT_2019.09.2>  (18) 
C=CCCN1C(=O)C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)C1=O

>  <INCHI_1.05_RDKIT_2019.09.2>  (18) 
InChI=1S/C17H31NO3Si/c1-8-9-10-18-16(19)11-15(17(18)20)21-22(12(2)3,13(4)5)14(6)7/h8,12-15H,1,9-11H2,2-7H3/t15-/m0/s1

>  <SUBSTANCE_COMMENT>  (18) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (18) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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  1  2  1  0
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  6  7  1  0
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  8  9  1  6
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 10 11  1  6
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
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 17 18  1  0
 17 19  1  0
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 20 21  1  0
 20 22  1  0
 15  6  1  0
 14  8  1  0
M  END
>  <DATASOURCE_REGID>  (19) 
UALIB-1886

>  <SMILES_RDKIT_2019.09.2>  (19) 
CC(C)[Si](O[C@H]1C[C@@]2(O)[C@H](C)CCN2C1=O)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (19) 
InChI=1S/C17H33NO3Si/c1-11(2)22(12(3)4,13(5)6)21-15-10-17(20)14(7)8-9-18(17)16(15)19/h11-15,20H,8-10H2,1-7H3/t14-,15+,17-/m1/s1

>  <SUBSTANCE_COMMENT>  (19) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (19) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 22 23  0  0  0  0  0  0  0  0999 V2000
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 20 21  1  0
 20 22  1  0
 15  6  1  0
 14  8  1  0
M  END
>  <DATASOURCE_REGID>  (20) 
UALIB-1887

>  <SMILES_RDKIT_2019.09.2>  (20) 
CC(C)[Si](O[C@H]1C[C@]2(O)[C@@H](C)CCN2C1=O)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (20) 
InChI=1S/C17H33NO3Si/c1-11(2)22(12(3)4,13(5)6)21-15-10-17(20)14(7)8-9-18(17)16(15)19/h11-15,20H,8-10H2,1-7H3/t14-,15-,17-/m0/s1

>  <SUBSTANCE_COMMENT>  (20) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (20) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (21) 
UALIB-1888

>  <SMILES_RDKIT_2019.09.2>  (21) 
CC(C)[Si](O[C@H]1C[C@H]2[C@@H](C)CCN2C1=O)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (21) 
InChI=1S/C17H33NO2Si/c1-11(2)21(12(3)4,13(5)6)20-16-10-15-14(7)8-9-18(15)17(16)19/h11-16H,8-10H2,1-7H3/t14-,15-,16-/m0/s1

>  <SUBSTANCE_COMMENT>  (21) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (21) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (22) 
UALIB-1889

>  <SMILES_RDKIT_2019.09.2>  (22) 
CC(C)[Si](O[C@H]1C[C@H]2[C@H](C)CCN2C1=O)(C(C)C)C(C)C

>  <INCHI_1.05_RDKIT_2019.09.2>  (22) 
InChI=1S/C17H33NO2Si/c1-11(2)21(12(3)4,13(5)6)20-16-10-15-14(7)8-9-18(15)17(16)19/h11-16H,8-10H2,1-7H3/t14-,15+,16+/m1/s1

>  <SUBSTANCE_COMMENT>  (22) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (22) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (23) 
UALIB-1890

>  <SMILES_RDKIT_2019.09.2>  (23) 
O=C1CCC2=C(CO)CCCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (23) 
InChI=1S/C9H13NO2/c11-6-7-2-1-5-10-8(7)3-4-9(10)12/h11H,1-6H2

>  <SUBSTANCE_COMMENT>  (23) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (23) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (24) 
UALIB-1891

>  <SMILES_RDKIT_2019.09.2>  (24) 
O=CC1=C2CCC(=O)N2CCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (24) 
InChI=1S/C9H11NO2/c11-6-7-2-1-5-10-8(7)3-4-9(10)12/h6H,1-5H2

>  <SUBSTANCE_COMMENT>  (24) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (24) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (25) 
UALIB-1892

>  <SMILES_RDKIT_2019.09.2>  (25) 
C=C(OCC)C(=O)C1=C2CCC(=O)N2CCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (25) 
InChI=1S/C13H17NO3/c1-3-17-9(2)13(16)10-5-4-8-14-11(10)6-7-12(14)15/h2-8H2,1H3

>  <SUBSTANCE_COMMENT>  (25) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (25) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (26) 
UALIB-1893

>  <SMILES_RDKIT_2019.09.2>  (26) 
CCOC1=C[C@]23CCC(=O)N2CCC[C@@H]3C1=O

>  <INCHI_1.05_RDKIT_2019.09.2>  (26) 
InChI=1S/C13H17NO3/c1-2-17-10-8-13-6-5-11(15)14(13)7-3-4-9(13)12(10)16/h8-9H,2-7H2,1H3/t9-,13+/m1/s1

>  <SUBSTANCE_COMMENT>  (26) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (26) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (27) 
UALIB-1894

>  <SMILES_RDKIT_2019.09.2>  (27) 
CCOC1=C[C@]23CCCN2CCC[C@@H]3[C@@H]1O

>  <INCHI_1.05_RDKIT_2019.09.2>  (27) 
InChI=1S/C13H21NO2/c1-2-16-11-9-13-6-4-8-14(13)7-3-5-10(13)12(11)15/h9-10,12,15H,2-8H2,1H3/t10-,12+,13+/m1/s1

>  <SUBSTANCE_COMMENT>  (27) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (27) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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M  END
>  <DATASOURCE_REGID>  (28) 
UALIB-1895

>  <SMILES_RDKIT_2019.09.2>  (28) 
O=C1CCC(=O)N1CCC1=CC2=C(C=C1)OCO2

>  <INCHI_1.05_RDKIT_2019.09.2>  (28) 
InChI=1S/C13H13NO4/c15-12-3-4-13(16)14(12)6-5-9-1-2-10-11(7-9)18-8-17-10/h1-2,7H,3-6,8H2

>  <SUBSTANCE_COMMENT>  (28) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (28) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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>  <DATASOURCE_REGID>  (29) 
UALIB-1896

>  <SMILES_RDKIT_2019.09.2>  (29) 
O=C1CCC(=O)N1CCC1=CC2=C(C=C1I)OCO2

>  <INCHI_1.05_RDKIT_2019.09.2>  (29) 
InChI=1S/C13H12INO4/c14-9-6-11-10(18-7-19-11)5-8(9)3-4-15-12(16)1-2-13(15)17/h5-6H,1-4,7H2

>  <SUBSTANCE_COMMENT>  (29) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (29) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

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>  <DATASOURCE_REGID>  (30) 
UALIB-1897

>  <SMILES_RDKIT_2019.09.2>  (30) 
C=CC1=CC2=C(C=C1CCN1C(=O)CCC1=O)OCO2

>  <INCHI_1.05_RDKIT_2019.09.2>  (30) 
InChI=1S/C15H15NO4/c1-2-10-7-12-13(20-9-19-12)8-11(10)5-6-16-14(17)3-4-15(16)18/h2,7-8H,1,3-6,9H2

>  <SUBSTANCE_COMMENT>  (30) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (30) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

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>  <DATASOURCE_REGID>  (31) 
UALIB-1898

>  <SMILES_RDKIT_2019.09.2>  (31) 
O=C1CC[C@]2(O)[C@@H](CO)C3=C(C=C4OCOC4=C3)CCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (31) 
InChI=1S/C15H17NO5/c17-7-11-10-6-13-12(20-8-21-13)5-9(10)2-4-16-14(18)1-3-15(11,16)19/h5-6,11,17,19H,1-4,7-8H2/t11-,15-/m0/s1

>  <SUBSTANCE_COMMENT>  (31) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (31) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

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>  <DATASOURCE_REGID>  (32) 
UALIB-1899

>  <SMILES_RDKIT_2019.09.2>  (32) 
C=C1C2=C(C=C3OCOC3=C2)CCN2C(=O)CCC12O.O=C1CCC2=C(CO)C3=C(C=C4OCOC4=C3)CCN12

>  <INCHI_1.05_RDKIT_2019.09.2>  (32) 
InChI=1S/2C15H15NO4/c1-9-11-7-13-12(19-8-20-13)6-10(11)3-5-16-14(17)2-4-15(9,16)18;17-7-11-10-6-14-13(19-8-20-14)5-9(10)3-4-16-12(11)1-2-15(16)18/h6-7,18H,1-5,8H2;5-6,17H,1-4,7-8H2

>  <SUBSTANCE_COMMENT>  (32) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (32) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

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>  <DATASOURCE_REGID>  (33) 
UALIB-1900

>  <SMILES_RDKIT_2019.09.2>  (33) 
O=CC1=C2CCC(=O)N2CCC2=C1C=C1OCOC1=C2

>  <INCHI_1.05_RDKIT_2019.09.2>  (33) 
InChI=1S/C15H13NO4/c17-7-11-10-6-14-13(19-8-20-14)5-9(10)3-4-16-12(11)1-2-15(16)18/h5-7H,1-4,8H2

>  <SUBSTANCE_COMMENT>  (33) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (33) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

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   -1.0842    8.7645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4051    8.0537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0323   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1470    1.7537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
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 18  8  1  0
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 14  9  1  0
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M  END
>  <DATASOURCE_REGID>  (34) 
UALIB-1901

>  <SMILES_RDKIT_2019.09.2>  (34) 
C=C(OCC)C(=O)C1=C2CCC(=O)N2CCC2=C1C=C1OCOC1=C2

>  <INCHI_1.05_RDKIT_2019.09.2>  (34) 
InChI=1S/C19H19NO5/c1-3-23-11(2)19(22)18-13-9-16-15(24-10-25-16)8-12(13)6-7-20-14(18)4-5-17(20)21/h8-9H,2-7,10H2,1H3

>  <SUBSTANCE_COMMENT>  (34) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (34) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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   -1.0323   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0323    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1470    1.7537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  1
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  4  8  2  0
  9  8  1  6
  9 10  1  0
 10 11  1  0
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  9  1  1  0
 14  9  1  0
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 18  1  1  0
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M  END
>  <DATASOURCE_REGID>  (35) 
UALIB-1902

>  <SMILES_RDKIT_2019.09.2>  (35) 
CCOC1=C[C@]23CCC(=O)N2CCC2=C(C=C4OCOC4=C2)[C@@H]3C1=O

>  <INCHI_1.05_RDKIT_2019.09.2>  (35) 
InChI=1S/C19H19NO5/c1-2-23-15-9-19-5-3-16(21)20(19)6-4-11-7-13-14(25-10-24-13)8-12(11)17(19)18(15)22/h7-9,17H,2-6,10H2,1H3/t17-,19+/m1/s1

>  <SUBSTANCE_COMMENT>  (35) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (35) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 24 28  0  0  0  0  0  0  0  0999 V2000
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    2.4199    2.5506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0
  2  3  1  6
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  4  8  2  0
  9  8  1  1
  9 10  1  0
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  9  1  1  0
 13  9  1  0
 24 16  1  0
  1 17  1  6
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M  END
>  <DATASOURCE_REGID>  (36) 
UALIB-1903

>  <SMILES_RDKIT_2019.09.2>  (36) 
CCOC1=C[C@]23CCCN2CCC2=C(C=C4OCOC4=C2)[C@@H]3[C@@H]1O

>  <INCHI_1.05_RDKIT_2019.09.2>  (36) 
InChI=1S/C19H23NO4/c1-2-22-16-10-19-5-3-6-20(19)7-4-12-8-14-15(24-11-23-14)9-13(12)17(19)18(16)21/h8-10,17-18,21H,2-7,11H2,1H3/t17-,18-,19+/m1/s1

>  <SUBSTANCE_COMMENT>  (36) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (36) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 24 26  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  6
  2  3  1  0
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  8  3  1  0
 12  9  1  0
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M  END
>  <DATASOURCE_REGID>  (37) 
UALIB-1904

>  <SMILES_RDKIT_2019.09.2>  (37) 
O[C@@H](C1=CCCCC1)C1(O)CC1.O[C@H](C1=CCCCC1)C1(O)CC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (37) 
InChI=1S/2C10H16O2/c2*11-9(10(12)6-7-10)8-4-2-1-3-5-8/h2*4,9,11-12H,1-3,5-7H2/t2*9-/m10/s1

>  <SUBSTANCE_COMMENT>  (37) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (37) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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  2  1  1  1
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  9 10  1  0
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  5  2  1  0
 11  6  1  0
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M  END
>  <DATASOURCE_REGID>  (38) 
UALIB-1905

>  <SMILES_RDKIT_2019.09.2>  (38) 
O[C@@H]1CC[C@@H]1C1=CCCCC1.O[C@H]1CC[C@H]1C1=CCCCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (38) 
InChI=1S/2C10H16O/c2*11-10-7-6-9(10)8-4-2-1-3-5-8/h2*4,9-11H,1-3,5-7H2/t2*9-,10-/m10/s1

>  <SUBSTANCE_COMMENT>  (38) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (38) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 22 24  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  1
  2  3  1  0
  3  4  1  0
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  5  6  1  6
  6  7  2  0
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  9 10  1  0
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 20 21  1  0
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  5  2  1  0
 11  6  1  0
 16 13  1  0
 22 17  1  0
M  END
>  <DATASOURCE_REGID>  (39) 
UALIB-1906

>  <SMILES_RDKIT_2019.09.2>  (39) 
O[C@@H]1CC[C@H]1C1=CCCCC1.O[C@H]1CC[C@@H]1C1=CCCCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (39) 
InChI=1S/2C10H16O/c2*11-10-7-6-9(10)8-4-2-1-3-5-8/h2*4,9-11H,1-3,5-7H2/t2*9-,10+/m10/s1

>  <SUBSTANCE_COMMENT>  (39) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (39) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  6
 12 13  1  6
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
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 19 20  1  0
 20 21  1  0
 21 22  1  1
  6  1  1  0
 17 12  1  0
 10  1  1  0
 21 12  1  0
M  END
>  <DATASOURCE_REGID>  (40) 
UALIB-1907

>  <SMILES_RDKIT_2019.09.2>  (40) 
O[C@@H]1CCC=C2CCCC[C@H]21.O[C@H]1CCC=C2CCCC[C@@H]21

>  <INCHI_1.05_RDKIT_2019.09.2>  (40) 
InChI=1S/2C10H16O/c2*11-10-7-3-5-8-4-1-2-6-9(8)10/h2*5,9-11H,1-4,6-7H2/t2*9-,10-/m10/s1

>  <SUBSTANCE_COMMENT>  (40) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (40) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

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  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  6
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 12 13  2  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  1
 17 18  2  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
  5  2  1  0
 11  6  1  0
 16 13  1  0
 22 17  1  0
M  END
>  <DATASOURCE_REGID>  (41) 
UALIB-1908

>  <SMILES_RDKIT_2019.09.2>  (41) 
O=C1CC[C@@H]1C1=CCCCC1.O=C1CC[C@H]1C1=CCCCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (41) 
InChI=1S/2C10H14O/c2*11-10-7-6-9(10)8-4-2-1-3-5-8/h2*4,9H,1-3,5-7H2/t2*9-/m10/s1

>  <SUBSTANCE_COMMENT>  (41) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (41) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 26 28  0  0  0  0  0  0  0  0999 V2000
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  2  1  1  6
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  6
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  9 10  1  0
 10 11  1  0
  2 12  1  0
 12 13  2  0
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 11  6  1  0
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M  END
>  <DATASOURCE_REGID>  (42) 
UALIB-1909

>  <SMILES_RDKIT_2019.09.2>  (42) 
C=C[C@@]1(O)CC[C@@H]1C1=CCCCC1.C=C[C@]1(O)CC[C@H]1C1=CCCCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (42) 
InChI=1S/2C12H18O/c2*1-2-12(13)9-8-11(12)10-6-4-3-5-7-10/h2*2,6,11,13H,1,3-5,7-9H2/t2*11-,12-/m10/s1

>  <SUBSTANCE_COMMENT>  (42) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (42) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$

     RDKit          2D

 26 28  0  0  0  0  0  0  0  0999 V2000
    4.3978   -3.3745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  6
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 11  6  1  0
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M  END
>  <DATASOURCE_REGID>  (43) 
UALIB-1910

>  <SMILES_RDKIT_2019.09.2>  (43) 
C=C[C@@]1(O)CC[C@H]1C1=CCCCC1.C=C[C@]1(O)CC[C@@H]1C1=CCCCC1

>  <INCHI_1.05_RDKIT_2019.09.2>  (43) 
InChI=1S/2C12H18O/c2*1-2-12(13)9-8-11(12)10-6-4-3-5-7-10/h2*2,6,11,13H,1,3-5,7-9H2/t2*11-,12+/m10/s1

>  <SUBSTANCE_COMMENT>  (43) 
Kim, S.-H. Titanium-mediated cyclization reactions: I. New synthetic methods for alkaloids; II. [1,3]- and [3,3]-Sigmatropic rearrangements of vinylcyclobutanols. Ph.D. Thesis, The University of Alabama, 2002.

>  <SUBSTANCE_URL>  (43) 
http://library.ua.edu/vwebv/holdingsInfo?bibId=1556448

$$$$
