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CHEBI:52134 - oxacillin sodium

ChEBI IDCHEBI:52134
ChEBI Nameoxacillin sodium
Stars
Last Modified17 October 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC19H18N3O5S.Na
Net Charge0
Average Mass423.426
Monoisotopic Mass423.08649
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)c1c(-c2ccccc2)noc1C.[Na+]
InChIInChI=1S/C19H19N3O5S.Na/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22;/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26);/q;+1/p-1/t13-,14+,17-;/m1./s1
InChIKeyVDUVBBMAXXHEQP-SLINCCQESA-M
ChEBI Ontology
Outgoing Relation(s)
oxacillin sodium (CHEBI:52134) has part oxacillin(1−) (CHEBI:52132)
oxacillin sodium (CHEBI:52134) is a organic sodium salt (CHEBI:38700)
Incoming Relation(s)
oxacillin sodium monohydrate (CHEBI:7810) has part oxacillin sodium (CHEBI:52134)
IUPAC Name 
sodium 2,2-dimethyl-6β-(5-methyl-3-phenyl-1,2-oxazole-4-carboxamido)penam-3α-carboxylate
Synonyms  Source
oxacillin sodium saltChemIDplus
sodium 6β-(5-methyl-3-phenylisoxazol-4-yl)penicillanateChEBI
Manual XrefsDatabases
DB00713DrugBank
Registry NumbersSources
Beilstein:4287093Beilstein
CAS:1173-88-2ChemIDplus