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CHEBI:34535 - ampicillin sodium

ChEBI IDCHEBI:34535
ChEBI Nameampicillin sodium
Stars
Last Modified12 January 2009
DownloadsMolfile
FormulaC16H18N3O4S.Na
Net Charge0
Average Mass371.394
Monoisotopic Mass371.09157
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1.[Na+]
InChIInChI=1S/C16H19N3O4S.Na/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);/q;+1/p-1/t9-,10-,11+,14-;/m1./s1
InChIKeyKLOHDWPABZXLGI-YWUHCJSESA-M
ChEBI Ontology
Outgoing Relation(s)
ampicillin sodium (CHEBI:34535) has part ampicillin(1−) (CHEBI:50658)
ampicillin sodium (CHEBI:34535) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
sodium 6β-[(2R)-2-amino-2-phenylacetamido]-2,2-dimethylpenam-3α-carboxylate
Synonyms  Source
Ampicillin sodiumKEGG COMPOUND
sodium (2S,5R,6R)-6-{[(2R)-2-amino-2-phenylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylateIUPAC
sodium D-(−)-α-aminobenzylpenicillinChemIDplus
monosodium D-(−)-6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylateChemIDplus
D(−)-α-aminobenzylpenicillin sodium saltChemIDplus
ampicillin natriumChemIDplus
Brand Names  Source
BinotalDrugBank
AustrapenDrugBank
Manual XrefsDatabases
C13652KEGG COMPOUND
DB00415DrugBank
D02119KEGG DRUG
Registry NumbersSources
Beilstein:5403793Beilstein
CAS:69-52-3ChemIDplus