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

Details

Stereochemistry UNKNOWN
Molecular Formula C19H20ClN3O6S
Molecular Weight 453.897
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLOXACILLIN PENICILLOIC ACID

SMILES

CC1=C(C(=O)NC(C2N[C@@H](C(O)=O)C(C)(C)S2)C(O)=O)C(=NO1)C3=CC=CC=C3Cl

InChI

InChIKey=DULNZIMTIHIZEK-BBBYJDLNSA-N
InChI=1S/C19H20ClN3O6S/c1-8-11(12(23-29-8)9-6-4-5-7-10(9)20)15(24)21-13(17(25)26)16-22-14(18(27)28)19(2,3)30-16/h4-7,13-14,16,22H,1-3H3,(H,21,24)(H,25,26)(H,27,28)/t13?,14-,16?/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CLOXACILLIN PENICILLOIC ACID
Common Name English
(4S)-2-(CARBOXY(((3-(2-CHLOROPHENYL)-5-METHYL-1,2-OXAZOL-4-YL)CARBONYL)AMINO)METHYL)-5,5-DIMETHYL-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID
Systematic Name English
(4S)-2-(CARBOXY(3-(2-CHLOROPHENYL)-5-METHYLISOXAZOLE-4-CARBOXAMIDO)METHYL)-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID
Systematic Name English
CLOXACILLIN SODIUM IMPURITY A [EP IMPURITY]
Common Name English
Code System Code Type Description
CAS
1642629-96-6
Created by admin on Sat Dec 16 11:11:24 GMT 2023 , Edited by admin on Sat Dec 16 11:11:24 GMT 2023
PRIMARY
PUBCHEM
155801575
Created by admin on Sat Dec 16 11:11:24 GMT 2023 , Edited by admin on Sat Dec 16 11:11:24 GMT 2023
PRIMARY PUBCHEM
FDA UNII
JEA3JWP5FY
Created by admin on Sat Dec 16 11:11:24 GMT 2023 , Edited by admin on Sat Dec 16 11:11:24 GMT 2023
PRIMARY