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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H11N6O6S3.Na
Molecular Weight 430.416
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DES(2-HYDROXY-2-PHENYL-ACETYL)CEFONICID SODIUM

SMILES

[Na+].[H][C@]12SCC(CSC3=NN=NN3CS([O-])(=O)=O)=C(N1C(=O)[C@H]2N)C(O)=O

InChI

InChIKey=ITZLQMICXIARKK-KPSHTFFOSA-M
InChI=1S/C10H12N6O6S3.Na/c11-5-7(17)16-6(9(18)19)4(1-23-8(5)16)2-24-10-12-13-14-15(10)3-25(20,21)22;/h5,8H,1-3,11H2,(H,18,19)(H,20,21,22);/q;+1/p-1/t5-,8-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DES(2-HYDROXY-2-PHENYL-ACETYL)CEFONICID SODIUM
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-AMINO-8-OXO-3-(((1-(SULFOMETHYL)-1H-TETRAZOL-5-YL)THIO)METHYL)-, SODIUM SALT (1:1), (6R,7R)-
Systematic Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-AMINO-8-OXO-3-(((1-(SULFOMETHYL)-1H-TETRAZOL-5-YL)THIO)METHYL)-, MONOSODIUM SALT, (6R-TRANS)-
Systematic Name English
Code System Code Type Description
FDA UNII
5LV81ZD6YA
Created by admin on Fri Dec 15 15:33:28 GMT 2023 , Edited by admin on Fri Dec 15 15:33:28 GMT 2023
PRIMARY
PUBCHEM
137321890
Created by admin on Fri Dec 15 15:33:28 GMT 2023 , Edited by admin on Fri Dec 15 15:33:28 GMT 2023
PRIMARY
CAS
71420-85-4
Created by admin on Fri Dec 15 15:33:28 GMT 2023 , Edited by admin on Fri Dec 15 15:33:28 GMT 2023
NON-SPECIFIC STOICHIOMETRY
CAS
101372-84-3
Created by admin on Fri Dec 15 15:33:28 GMT 2023 , Edited by admin on Fri Dec 15 15:33:28 GMT 2023
PRIMARY