Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C12H14N2O3.C10H16O4S |
| Molecular Weight | 466.548 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1(C)[C@@H]2CC[C@@]1(CS(O)(=O)=O)C(=O)C2.CC3=NC4=CC=CC=C4C(=O)N3CC(O)CO
InChI
InChIKey=AJNMCFBQWSXQHS-STOWLHSFSA-N
InChI=1S/C12H14N2O3.C10H16O4S/c1-8-13-11-5-3-2-4-10(11)12(17)14(8)6-9(16)7-15;1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14/h2-5,9,15-16H,6-7H2,1H3;7H,3-6H2,1-2H3,(H,12,13,14)/t;7-,10-/m.1/s1
| Molecular Formula | C12H14N2O3 |
| Molecular Weight | 234.2512 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | C10H16O4S |
| Molecular Weight | 232.297 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 07:55:32 UTC 2023
by
admin
on
Sat Dec 16 07:55:32 UTC 2023
|
| Record UNII |
92QYQ513QO
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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92QYQ513QO
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100000087537
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118984423
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DTXSID70980345
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63768-21-8
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SUB01792MIG
Created by
admin on Sat Dec 16 07:55:32 UTC 2023 , Edited by admin on Sat Dec 16 07:55:32 UTC 2023
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