USCHARIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H41NO8S
Molecular Weight	587.724
Optical Activity	UNSPECIFIED
Defined Stereocenters	13 / 13
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@]3([H])CC[C@]4([H])[C@]([H])(CC[C@]5(C)[C@H](CC[C@]45O)C6=CC(=O)OC6)[C@]3(C[C@@]1([H])O[C@]7(O)[C@@]([H])(O[C@H](C)C[C@]78SCC=N8)O2)C=O

InChI

InChIKey=DONIPVCAKBPJLH-IGACXKNBSA-N

InChI=1S/C31H41NO8S/c1-17-13-30(32-9-10-41-30)31(36)26(38-17)39-23-12-19-3-4-22-21(28(19,16-33)14-24(23)40-31)5-7-27(2)20(6-8-29(22,27)35)18-11-25(34)37-15-18/h9,11,16-17,19-24,26,35-36H,3-8,10,12-15H2,1-2H3/t17-,19+,20-,21+,22-,23-,24-,26+,27-,28-,29+,30+,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H41NO8S
Molecular Weight	587.724
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	13 / 13
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 00:41:45 GMT 2023` Edited by `admin` on `Sat Dec 16 00:41:45 GMT 2023`
Record UNII	L7XQV67FTV
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

USCHARIN

Common Name

English

CARD-20(22)-ENOLIDE, 14-HYDROXY-2,3-(((5S,6R,7S,9R)-6-HYDROXY-9-METHYL-8-OXA-1-THIA-4-AZASPIRO(4.5)DEC-3-ENE-6,7-DIYL)BIS(OXY))-19-OXO-, (2.ALPHA.,3.BETA.,5.ALPHA.)-

Systematic Name

English

USCHARINE

Common Name

English

USCHARIN [MI]

Common Name

English

CARD-20(22)-ENOLIDE, 14-HYDROXY-2,3-((6-HYDROXY-9-METHYL-8-OXA-1-THIA-4-AZASPIRO(4.5)DEC-3-ENE-6,7-DIYL)BIS(OXY))-19-OXO-, (2.ALPHA.(5S,6R,7S,9R),3.BETA.,5.ALPHA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

11261800

Created by admin on Sat Dec 16 00:41:45 GMT 2023 , Edited by admin on Sat Dec 16 00:41:45 GMT 2023

PRIMARY

FDA UNII

L7XQV67FTV

Created by admin on Sat Dec 16 00:41:45 GMT 2023 , Edited by admin on Sat Dec 16 00:41:45 GMT 2023

PRIMARY

CAS

24211-81-2

Created by admin on Sat Dec 16 00:41:45 GMT 2023 , Edited by admin on Sat Dec 16 00:41:45 GMT 2023

PRIMARY

EPA CompTox

DTXSID60947028

Created by admin on Sat Dec 16 00:41:45 GMT 2023 , Edited by admin on Sat Dec 16 00:41:45 GMT 2023

PRIMARY