CHEBI:34535 - ampicillin sodium

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name ampicillin sodium
ChEBI ID CHEBI:34535
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H18N3O4S.Na
Net Charge 0
Average Mass 371.38771
Monoisotopic Mass 371.092
InChI InChI=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
InChIKey KLOHDWPABZXLGI-YWUHCJSESA-M
SMILES [Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1)C([O-])=O
ChEBI Ontology
Outgoing 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 Sources
ampicillin natrium ChemIDplus
Ampicillin sodium KEGG COMPOUND
D(−)-α-aminobenzylpenicillin sodium salt ChemIDplus
monosodium D-(−)-6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate ChemIDplus
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-carboxylate IUPAC
sodium ampicillin ChemIDplus
sodium D-(−)-α-aminobenzylpenicillin ChemIDplus
Brand Names Sources
Austrapen DrugBank
Binotal DrugBank
Database Links Databases
C13652 KEGG COMPOUND
D02119 KEGG DRUG
DB00415 DrugBank
View more database links
Registry Numbers Types Sources
5403793 Beilstein Registry Number Beilstein
69-52-3 CAS Registry Number ChemIDplus
Last Modified
12 January 2009