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CHEBI:31376 - Cefpimizole sodium

Default Structure
ChEBI IDCHEBI:31376
ChEBI NameCefpimizole sodium
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC28H25N6O10S2.Na
Net Charge0
Average Mass692.664
Monoisotopic Mass692.09713
SMILES[H][C@]12SCC(C[n+]3ccc(CCS(=O)(=O)[O-])cc3)=C(C(=O)[O-])N1C(=O)[C@H]2NC(=O)[C@H](NC(=O)c1cnc(C(=O)O)n1)c1ccccc1.[Na+]
InChIInChI=1S/C28H26N6O10S2.Na/c35-23(18-12-29-22(30-18)28(40)41)31-19(16-4-2-1-3-5-16)24(36)32-20-25(37)34-21(27(38)39)17(14-45-26(20)34)13-33-9-6-15(7-10-33)8-11-46(42,43)44;/h1-7,9-10,12,19-20,26H,8,11,13-14H2,(H5-,29,30,31,32,35,36,38,39,40,41,42,43,44);/q;+1/p-1/t19-,20-,26-;/m1./s1
InChIKeyAFRHBNZCLNRBKP-USSRSQKSSA-M
ChEBI Ontology
Outgoing Relation(s)
Cefpimizole sodium (CHEBI:31376) is a organic molecular entity (CHEBI:50860)
Synonym  Source
Cefpimizole sodiumKEGG COMPOUND
Manual XrefsDatabases
C13024KEGG COMPOUND
D01568KEGG DRUG
Registry NumbersSources
CAS:85287-61-2KEGG COMPOUND