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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12N2O5S
Molecular Weight 272.278
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-AMINOCEPHALOSPORANIC ACID

SMILES

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

InChI

InChIKey=HSHGZXNAXBPPDL-HZGVNTEJSA-N
InChI=1S/C10H12N2O5S/c1-4(13)17-2-5-3-18-9-6(11)8(14)12(9)7(5)10(15)16/h6,9H,2-3,11H2,1H3,(H,15,16)/t6-,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H12N2O5S
Molecular Weight 272.278
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 Fri Dec 15 15:01:59 UTC 2023
Edited
by admin
on Fri Dec 15 15:01:59 UTC 2023
Record UNII
9XI67897RG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-AMINOCEPHALOSPORANIC ACID
MI  
Common Name English
CEFTRIAXONE SODIUM IMPURITY E [IP]
Common Name English
CEFAZOLIN SODIUM IMPURITY H [EP IMPURITY]
Common Name English
7-ACA
Common Name English
3-(ACETOXYMETHYL)-7-AMINOCEPHEM-4-CARBOXYLIC ACID
Common Name English
CEFOPERAZONE SODIUM IMPURITY E [EP IMPURITY]
Common Name English
(7R)-7-AMINOCEPHALOSPORANIC ACID
Common Name English
7.BETA.-AMINO-3-ACETOXYMETHYLCEPHEMCARBOXYLIC ACID
Common Name English
(6R,7R)-3-((ACETYLOXY)METHYL)-7-AMINO-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
3-ACETOXYMETHYL-7.BETA.-AMINOCEPH-3-EM-4-CARBOXYLIC ACID
Common Name English
7.BETA.-AMINOCEPHALOSPORANIC ACID
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 3-((ACETYLOXY)METHYL)-7-AMINO-8-OXO-, (6R,7R)-
Systematic Name English
7-AMINOCEPHALOSPORANIC ACID [MI]
Common Name English
7-Aminocephalosporanic acid [WHO-DD]
Common Name English
Code System Code Type Description
FDA UNII
9XI67897RG
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
ECHA (EC/EINECS)
213-485-0
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
CHEBI
2255
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
MERCK INDEX
m1699
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY Merck Index
PUBCHEM
441328
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
CAS
957-68-6
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
MESH
C030735
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
WIKIPEDIA
7-ACA
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
EPA CompTox
DTXSID9045342
Created by admin on Fri Dec 15 15:01:59 UTC 2023 , Edited by admin on Fri Dec 15 15:01:59 UTC 2023
PRIMARY
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