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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20N4O4S3
Molecular Weight 428.549
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CEFAZOLIN PIVALOYL

SMILES

[H][C@]12SCC(CSC3=NN=C(C)S3)=C(N1C(=O)[C@H]2NC(=O)C(C)(C)C)C(O)=O

InChI

InChIKey=PYQNLAKCAGCVKA-BXKDBHETSA-N
InChI=1S/C16H20N4O4S3/c1-7-18-19-15(27-7)26-6-8-5-25-12-9(17-14(24)16(2,3)4)11(21)20(12)10(8)13(22)23/h9,12H,5-6H2,1-4H3,(H,17,24)(H,22,23)/t9-,12-/m1/s1

HIDE SMILES / InChI
Molecular Formula C16H20N4O4S3
Molecular Weight 428.549
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 10:51:24 UTC 2023
Edited
by admin
on Sat Dec 16 10:51:24 UTC 2023
Record UNII
705J53S4IH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFAZOLIN PIVALOYL
Common Name English
CEFAZOLIN SODIUM IMPURITY B [EP IMPURITY]
Common Name English
(6R,7R)-7-((2,2-DIMETHYLPROPANOYL)AMINO)-3-(((5-METHYL-1,3,4-THIADIAZOL-2-YL)SULFANYL)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, 7-((2,2-DIMETHYL-1-OXOPROPYL)AMINO)-3-(((5-METHYL-1,3,4-THIADIAZOL-2-YL)THIO)METHYL)-8-OXO-, (6R,7R)-
Systematic Name English
(6R,7R)-3-((5-METHYL-1,3,4-THIADIAZOL-2-YLTHIO)METHYL)-8-OXO-7-PIVALAMIDO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
124519572
Created by admin on Sat Dec 16 10:51:24 UTC 2023 , Edited by admin on Sat Dec 16 10:51:24 UTC 2023
PRIMARY
FDA UNII
705J53S4IH
Created by admin on Sat Dec 16 10:51:24 UTC 2023 , Edited by admin on Sat Dec 16 10:51:24 UTC 2023
PRIMARY
CAS
2384108-14-7
Created by admin on Sat Dec 16 10:51:24 UTC 2023 , Edited by admin on Sat Dec 16 10:51:24 UTC 2023
PRIMARY
Related Record Type Details
Structure of CEFAZOLIN SODIUM
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of CEFAZOLIN
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of CEFAZOLIN SODIUM
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
NIH
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