Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C23H35NO2.CH4O3S |
| Molecular Weight | 453.635 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CCCCCC(=O)CC[C@]1(C)[C@H]2CC3=CC=C(O)C=C3[C@]1(C)CCN2C
InChI
InChIKey=CQSTVPYARYSBNS-HZLAGBECSA-N
InChI=1S/C23H35NO2.CH4O3S/c1-5-6-7-8-18(25)11-12-23(3)21-15-17-9-10-19(26)16-20(17)22(23,2)13-14-24(21)4;1-5(2,3)4/h9-10,16,21,26H,5-8,11-15H2,1-4H3;1H3,(H,2,3,4)/t21-,22+,23-;/m1./s1
Approval Year
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NCI_THESAURUS |
C67413
Created by
admin on Fri Dec 15 16:07:10 UTC 2023 , Edited by admin on Fri Dec 15 16:07:10 UTC 2023
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DTXSID90994722
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C81379
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CHEMBL2111044
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76965006
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73789-00-1
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2F5K551CB4
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ACTIVE MOIETY
SUBSTANCE RECORD