U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H20N2O6S
Molecular Weight 380.415
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-(SULFOOXY)-TROPISETRON

SMILES

CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C3=CNC4=C3C=CC=C4OS(O)(=O)=O

InChI

InChIKey=LQGNUCFJUGLPFC-GDNZZTSVSA-N
InChI=1S/C17H20N2O6S/c1-19-10-5-6-11(19)8-12(7-10)24-17(20)14-9-18-16-13(14)3-2-4-15(16)25-26(21,22)23/h2-4,9-12,18H,5-8H2,1H3,(H,21,22,23)/t10-,11+,12+

HIDE SMILES / InChI

Approval Year

Name Type Language
7-(SULFOOXY)-TROPISETRON
Common Name English
1H-INDOLE-3-CARBOXYLIC ACID, 7-(SULFOOXY)-, 3-(8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL) ESTER, ENDO-
Common Name English
Code System Code Type Description
FDA UNII
COR00KN1FE
Created by admin on Sat Dec 16 16:14:30 GMT 2023 , Edited by admin on Sat Dec 16 16:14:30 GMT 2023
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CAS
124077-61-8
Created by admin on Sat Dec 16 16:14:30 GMT 2023 , Edited by admin on Sat Dec 16 16:14:30 GMT 2023
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