PENICILLOIC ACIDS OF OXACILLIN

Details

Stereochemistry	EPIMERIC
Molecular Formula	C19H21N3O6S
Molecular Weight	419.452
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PENICILLOIC ACIDS OF OXACILLIN

Structure Search

SMILES

CC1=C(C(=O)NC(C2N[C@@H](C(O)=O)C(C)(C)S2)C(O)=O)C(=NO1)C3=CC=CC=C3

InChI

InChIKey=JCHZLBSPYSDECZ-BBBYJDLNSA-N

InChI=1S/C19H21N3O6S/c1-9-11(12(22-28-9)10-7-5-4-6-8-10)15(23)20-13(17(24)25)16-21-14(18(26)27)19(2,3)29-16/h4-8,13-14,16,21H,1-3H3,(H,20,23)(H,24,25)(H,26,27)/t13?,14-,16?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H21N3O6S
Molecular Weight	419.452
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	1 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:36:28 GMT 2025` Edited by `admin` on `Mon Mar 31 23:36:28 GMT 2025`
Record UNII	R2Y3N452C4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENICILLOIC ACIDS OF OXACILLIN

Common Name

English

OXACILLIN SODIUM MONOHYDRATE IMPURITY B [EP IMPURITY]

Preferred Name

English

(4S)-2-(CARBOXY(((5-METHYL-3-PHENYLISOXAZOL-4-YL)CARBONYL)AMINO)METHYL)-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID

Systematic Name

English

2-THIAZOLIDINEACETIC ACID, 4-CARBOXY-5,5-DIMETHYL-.ALPHA.-(((5-METHYL-3-PHENYL-4-ISOXAZOLYL)CARBONYL)AMINO)-, (4S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

R2Y3N452C4

Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025

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CAS

1642629-95-5

Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025

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PUBCHEM

156596485

Created by admin on Mon Mar 31 23:36:28 GMT 2025 , Edited by admin on Mon Mar 31 23:36:28 GMT 2025

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Related Record Type Details


					G0V6C994Q5

OXACILLIN SODIUM

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: