5-(SULFOOXY)-TROPISETRON

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 Search

SMILES

CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C3=CNC4=C3C=C(OS(O)(=O)=O)C=C4

InChI

InChIKey=GKDDDIXRCBLNII-PJXYFTJBSA-N

InChI=1S/C17H20N2O6S/c1-19-10-2-3-11(19)7-13(6-10)24-17(20)15-9-18-16-5-4-12(8-14(15)16)25-26(21,22)23/h4-5,8-11,13,18H,2-3,6-7H2,1H3,(H,21,22,23)/t10-,11+,13+

HIDE SMILES / InChI

Molecular Formula	C17H20N2O6S
Molecular Weight	380.415
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:42:19 GMT 2023` Edited by `admin` on `Sat Dec 16 16:42:19 GMT 2023`
Record UNII	PPU0K9J8IA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-(SULFOOXY)-TROPISETRON

Common Name

English

1H-INDOLE-3-CARBOXYLIC ACID, 5-(SULFOOXY)-, 3-(8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL) ESTER, ENDO-

Systematic Name

English

Code System Code Type Description

FDA UNII

PPU0K9J8IA

Created by admin on Sat Dec 16 16:42:19 GMT 2023 , Edited by admin on Sat Dec 16 16:42:19 GMT 2023

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CAS

124077-59-4

Created by admin on Sat Dec 16 16:42:19 GMT 2023 , Edited by admin on Sat Dec 16 16:42:19 GMT 2023

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TROPISETRON

PARENT -> METABOLITE