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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H18N2O4S
Molecular Weight 298.358
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-PIVALOYL 7-AMINODESACETOXYCEPHALOSPORANIC ACID

SMILES

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

InChI

InChIKey=JLNXDMISSHNIAD-GMSGAONNSA-N
InChI=1S/C13H18N2O4S/c1-6-5-20-10-7(14-12(19)13(2,3)4)9(16)15(10)8(6)11(17)18/h7,10H,5H2,1-4H3,(H,14,19)(H,17,18)/t7-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H18N2O4S
Molecular Weight 298.358
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 12:18:11 UTC 2023
Edited
by admin
on Thu Jul 06 12:18:11 UTC 2023
Record UNII
MDO0VUD5WQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-PIVALOYL 7-AMINODESACETOXYCEPHALOSPORANIC ACID
Common Name English
7-ADCA PIVALAMIDE
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-((2,2-DIMETHYL-1-OXOPROPYL)AMINO)-3-METHYL-8-OXO-, (6R-TRANS)-
Common Name English
(6R,7R)-7-((2,2-DIMETHYLPROPANOYL)AMINO)-3-METHYL-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
CEFADROXIL MONOHYDRATE IMPURITY H [EP IMPURITY]
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-((2,2-DIMETHYL-1-OXOPROPYL)AMINO)-3-METHYL-8-OXO-, (6R,7R)-
Common Name English
CEFRADINE IMPURITY G [EP IMPURITY]
Common Name English
CEFADROXIL IMPURITY H [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
14949331
Created by admin on Thu Jul 06 12:18:11 UTC 2023 , Edited by admin on Thu Jul 06 12:18:11 UTC 2023
PRIMARY
FDA UNII
MDO0VUD5WQ
Created by admin on Thu Jul 06 12:18:11 UTC 2023 , Edited by admin on Thu Jul 06 12:18:11 UTC 2023
PRIMARY
CAS
146794-70-9
Created by admin on Thu Jul 06 12:18:11 UTC 2023 , Edited by admin on Thu Jul 06 12:18:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
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EP