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Details

Stereochemistry ABSOLUTE
Molecular Formula C8H10N2O4S
Molecular Weight 230.241
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEACETYL-7-AMINOCEPHALOSPORANIC ACID

SMILES

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

InChI

InChIKey=BQIMPGFMMOZASS-CLZZGJSISA-N
InChI=1S/C8H10N2O4S/c9-4-6(12)10-5(8(13)14)3(1-11)2-15-7(4)10/h4,7,11H,1-2,9H2,(H,13,14)/t4-,7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C8H10N2O4S
Molecular Weight 230.241
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 Sat Dec 16 08:07:36 GMT 2023
Edited
by admin
on Sat Dec 16 08:07:36 GMT 2023
Record UNII
57NLN1Y39I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEACETYL-7-AMINOCEPHALOSPORANIC ACID
Common Name English
(+)-DEACETYL-7-AMINOCEPHALOSPORANIC ACID
Common Name English
7-AMINO-DEACETYLCEPHALOSPORANIC ACID
Common Name English
(6R,7R)-7-AMINO-3-HYDROXYMETHYLCEPH-3-EM-4-CARBOXYLIC ACID
Systematic Name English
3-HYDROXYMETHYL-7-AMINOCEPH-3-EM-4-CARBOXYLIC ACID
Common Name English
HACA
Common Name English
7.BETA.-AMINO-3-(HYDROXYMETHYL)-3-CEPHEM-4-CARBOXYLIC ACID
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-AMINO-3-(HYDROXYMETHYL)-8-OXO-, (6R,7R)-
Systematic Name English
Code System Code Type Description
CAS
15690-38-7
Created by admin on Sat Dec 16 08:07:36 GMT 2023 , Edited by admin on Sat Dec 16 08:07:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
239-787-2
Created by admin on Sat Dec 16 08:07:36 GMT 2023 , Edited by admin on Sat Dec 16 08:07:36 GMT 2023
PRIMARY
FDA UNII
57NLN1Y39I
Created by admin on Sat Dec 16 08:07:36 GMT 2023 , Edited by admin on Sat Dec 16 08:07:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID60935561
Created by admin on Sat Dec 16 08:07:36 GMT 2023 , Edited by admin on Sat Dec 16 08:07:36 GMT 2023
PRIMARY
PUBCHEM
11031679
Created by admin on Sat Dec 16 08:07:36 GMT 2023 , Edited by admin on Sat Dec 16 08:07:36 GMT 2023
PRIMARY