EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:31613 - Flomoxef sodium

ChEBI IDCHEBI:31613
ChEBI NameFlomoxef sodium
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC16H18F2N5O7S2.Na
Net Charge0
Average Mass517.468
Monoisotopic Mass517.05134
SMILES[H][C@]12OCC(CSc3nnnn3CCO)=C(C(=O)[O-])N1C(=O)[C@]2(CC(=O)CSC(F)F)OC.[Na+]
InChIInChI=1S/C16H19F2N5O7S2.Na/c1-29-16(4-9(25)7-31-14(17)18)12(28)23-10(11(26)27)8(5-30-13(16)23)6-32-15-19-20-21-22(15)2-3-24;/h13-14,24H,2-7H2,1H3,(H,26,27);/q;+1/p-1/t13-,16+;/m1./s1
InChIKeyOVMMHVNNFBJRNE-CACIRBSMSA-M
ChEBI Ontology
Outgoing Relation(s)
Flomoxef sodium (CHEBI:31613) has functional parent α-amino acid (CHEBI:33704)
Flomoxef sodium (CHEBI:31613) is a organonitrogen compound (CHEBI:35352)
Flomoxef sodium (CHEBI:31613) is a organooxygen compound (CHEBI:36963)
Synonyms  Source
Flomoxef sodiumKEGG COMPOUND
S 6315KEGG COMPOUND
Flumarin (TN)KEGG COMPOUND
Manual XrefsDatabases
D01473KEGG DRUG
Registry NumbersSources
CAS:92823-03-5KEGG COMPOUND