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CHEBI:31615 - flucloxacillin sodium

ChEBI IDCHEBI:31615
ChEBI Nameflucloxacillin sodium
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC19H16ClFN3O5S.Na
Net Charge0
Average Mass475.861
Monoisotopic Mass475.03809
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)c1c(-c2c(F)cccc2Cl)noc1C.[Na+]
InChIInChI=1S/C19H17ClFN3O5S.Na/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24;/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28);/q;+1/p-1/t13-,14+,17-;/m1./s1
InChIKeyOTEANHMVDHZOPB-SLINCCQESA-M
ChEBI Ontology
Outgoing Relation(s)
flucloxacillin sodium (CHEBI:31615) has part flucloxacillin(1−) (CHEBI:52037)
flucloxacillin sodium (CHEBI:31615) is a organic sodium salt (CHEBI:38700)
Incoming Relation(s)
flucloxacillin sodium monohydrate (CHEBI:52040) has part flucloxacillin sodium (CHEBI:31615)
IUPAC Name 
sodium 6β-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamido]-2,2-dimethylpenam-3α-carboxylate
Synonyms  Source
Flucloxacillin sodium saltKEGG DRUG
Flucloxacillin-SodiumDrugBank
Brand Name  Source
FloxapenKEGG DRUG
Manual XrefsDatabases
D07965KEGG DRUG
DB00301DrugBank
Registry NumbersSources
Beilstein:5402507Beilstein
CAS:1847-24-1KEGG DRUG