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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H12N6O4S
Molecular Weight 324.316
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEFAZOLIN 3-METHYL ANALOG

SMILES

[H][C@]12SCC(C)=C(N1C(=O)[C@H]2NC(=O)CN3C=NN=N3)C(O)=O

InChI

InChIKey=DGYURGWZOSQCFG-GMSGAONNSA-N
InChI=1S/C11H12N6O4S/c1-5-3-22-10-7(9(19)17(10)8(5)11(20)21)13-6(18)2-16-4-12-14-15-16/h4,7,10H,2-3H2,1H3,(H,13,18)(H,20,21)/t7-,10-/m1/s1

HIDE SMILES / InChI
Molecular Formula C11H12N6O4S
Molecular Weight 324.316
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:51:23 UTC 2023
Edited
by admin
on Sat Dec 16 10:51:23 UTC 2023
Record UNII
PGB16683CG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFAZOLIN 3-METHYL ANALOG
Common Name English
7-(1-(1H)-TETRAZOLYLACETAMIDO)DESACETOXYCEPHALOSPORANIC ACID
Systematic Name English
(6R,7R)-7-(2-(1H-TETRAZOL-1-YL)ACETAMIDO)-3-METHYL-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 3-METHYL-8-OXO-7-((1H-TETRAZOL-1-YLACETYL)AMINO)-, (6R-TRANS)-
Systematic Name English
7-(1-(1H)-TETRAZOLYLACETAMIDO)DEACETOXYCEPHALOSPORANIC ACID
Systematic Name English
CEFAZOLIN SODIUM IMPURITY C [EP IMPURITY]
Common Name English
(6R,7R)-3-METHYL-8-OXO-7-((1H-TETRAZOL-1-YLACETYL)AMINO)-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
129010479
Created by admin on Sat Dec 16 10:51:23 UTC 2023 , Edited by admin on Sat Dec 16 10:51:23 UTC 2023
PRIMARY
CAS
56842-77-4
Created by admin on Sat Dec 16 10:51:23 UTC 2023 , Edited by admin on Sat Dec 16 10:51:23 UTC 2023
PRIMARY
FDA UNII
PGB16683CG
Created by admin on Sat Dec 16 10:51:23 UTC 2023 , Edited by admin on Sat Dec 16 10:51:23 UTC 2023
PRIMARY
Related Record Type Details
Structure of CEFAZOLIN SODIUM
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of CEFAZOLIN
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of CEFAZOLIN SODIUM
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
NIH
NCATS
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