Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C17H23Cl2NO.CH4O3S |
| Molecular Weight | 424.382 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CC(C)N[C@@H]1C2CCC(CC2)[C@@]1(O)C3=CC=C(Cl)C(Cl)=C3
InChI
InChIKey=VALAKNBZUXDQCX-YTOIOIGGSA-N
InChI=1S/C17H23Cl2NO.CH4O3S/c1-10(2)20-16-11-3-5-12(6-4-11)17(16,21)13-7-8-14(18)15(19)9-13;1-5(2,3)4/h7-12,16,20-21H,3-6H2,1-2H3;1H3,(H,2,3,4)/t11?,12?,16-,17-;/m1./s1
Approval Year
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NCI_THESAURUS |
C265
Created by
admin on Fri Dec 15 15:20:42 UTC 2023 , Edited by admin on Fri Dec 15 15:20:42 UTC 2023
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69429-85-2
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C78008
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CHEMBL2110879
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C041367
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20055444
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SZ83PVQ06I
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DTXSID90989274
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admin on Fri Dec 15 15:20:42 UTC 2023 , Edited by admin on Fri Dec 15 15:20:42 UTC 2023
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ACTIVE MOIETY
SUBSTANCE RECORD
