CHEBI:31364 - Cefacetrile sodium

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Cefacetrile sodium
ChEBI ID CHEBI:31364
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H12N3O6S.Na
Net Charge 0
Average Mass 361.307
Monoisotopic Mass 361.034
InChI InChI=1S/C13H13N3O6S.Na/c1-6(17)22-4-7-5-23-12-9(15-8(18)2-3-14)11(19)16(12)10(7)13(20)21;/h9,12H,2,4-5H2,1H3,(H,15,18)(H,20,21);/q;+1/p-1/t9-,12-;/m1./s1
InChIKey GXCRUTWHNMMJEK-WYUVZMMLSA-M
SMILES [Na+].CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)CC#N)C2=O)C([O-])=O
ChEBI Ontology
Outgoing Cefacetrile sodium (CHEBI:31364) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
Cefacetrile sodium KEGG COMPOUND
Cephacetrile sodium KEGG COMPOUND
Manual Xrefs Databases
C12691 KEGG COMPOUND
D01262 KEGG DRUG
View more database links
Registry Number Type Source
23239-41-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014