PF-00398899

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H31NO8S3
Molecular Weight	533.678
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H](O)[C@@H]1[C@H]2SC(S[C@H]3CC[S@@+]([O-])C3)=C(N2C1=O)C(=O)OCOC(=O)OC4CCC(C)(C)CC4

InChI

InChIKey=GFSMHHIGZHSQEV-IAPLWUSQSA-N

InChI=1S/C22H31NO8S3/c1-12(24)15-17(25)23-16(20(33-18(15)23)32-14-6-9-34(28)10-14)19(26)29-11-30-21(27)31-13-4-7-22(2,3)8-5-13/h12-15,18,24H,4-11H2,1-3H3/t12-,14+,15+,18-,34-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H31NO8S3
Molecular Weight	533.678
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:25:36 GMT 2025` Edited by `admin` on `Wed Apr 02 12:25:36 GMT 2025`
Record UNII	5ZM2PJ365E
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PF-00398899

Code

English

PF00398899

Preferred Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPT-2-ENE-2-CARBOXYLIC ACID, 6-((1R)-1-HYDROXYETHYL)-7-OXO-3-(((1R,3S)-TETRAHYDRO-1-OXIDO-3-THIENYL)THIO)-, ((((4,4-DIMETHYLCYCLOHEXYL)OXY)CARBONYL)OXY)METHYL ESTER, (5R,6S)-

Systematic Name

English

Code System Code Type Description

CAS

1000296-76-3

Created by admin on Wed Apr 02 12:25:36 GMT 2025 , Edited by admin on Wed Apr 02 12:25:36 GMT 2025

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FDA UNII

5ZM2PJ365E

Created by admin on Wed Apr 02 12:25:36 GMT 2025 , Edited by admin on Wed Apr 02 12:25:36 GMT 2025

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PUBCHEM

59460544

Created by admin on Wed Apr 02 12:25:36 GMT 2025 , Edited by admin on Wed Apr 02 12:25:36 GMT 2025

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