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CHEBI:51762 - azidocillin(1−)

ChEBI IDCHEBI:51762
ChEBI Nameazidocillin(1−)
Stars
ASCII Nameazidocillin(1-)
Last Modified27 February 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC16H16N5O4S
Net Charge-1
Average Mass374.402
Monoisotopic Mass374.09285
SMILES[H][C@]12SC(C)(C)[C@H](C(=O)[O-])N1C(=O)[C@H]2NC(=O)[C@H](N=[N+]=[N-])c1ccccc1
InChIInChI=1S/C16H17N5O4S/c1-16(2)11(15(24)25)21-13(23)10(14(21)26-16)18-12(22)9(19-20-17)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,18,22)(H,24,25)/p-1/t9-,10-,11+,14-/m1/s1
InChIKeyODFHGIPNGIAMDK-NJBDSQKTSA-M
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
azidocillin(1−) (CHEBI:51762) is a penicillinate anion (CHEBI:51356)
azidocillin(1−) (CHEBI:51762) is conjugate base of azidocillin (CHEBI:51758)
Incoming Relation(s)
azidocillin sodium (CHEBI:51761) has part azidocillin(1−) (CHEBI:51762)
azidocillin (CHEBI:51758) is conjugate acid of azidocillin(1−) (CHEBI:51762)
IUPAC Name 
2,2-dimethyl-6β-[(2R)-2-azido-2-phenylacetamido]penam-3α-carboxylate
Synonym  Source
(2S,5R,6R)-6-{[(2R)-2-azido-2-phenylacetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylateIUPAC