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CHEBI:51863 - azlocillin(1−)

ChEBI IDCHEBI:51863
ChEBI Nameazlocillin(1−)
Stars
ASCII Nameazlocillin(1-)
Last Modified3 January 2013
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC20H22N5O6S
Net Charge-1
Average Mass460.492
Monoisotopic Mass460.12963
SMILES[H][C@](NC(=O)N1CCNC1=O)(C(=O)N[C@@H]1C(=O)N2[C@@H](C(=O)[O-])C(C)(C)S[C@]12[H])c1ccccc1
InChIInChI=1S/C20H23N5O6S/c1-20(2)13(17(28)29)25-15(27)12(16(25)32-20)22-14(26)11(10-6-4-3-5-7-10)23-19(31)24-9-8-21-18(24)30/h3-7,11-13,16H,8-9H2,1-2H3,(H,21,30)(H,22,26)(H,23,31)(H,28,29)/p-1/t11-,12-,13+,16-/m1/s1
InChIKeyJTWOMNBEOCYFNV-NFFDBFGFSA-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)
azlocillin(1−) (CHEBI:51863) is a penicillinate anion (CHEBI:51356)
azlocillin(1−) (CHEBI:51863) is conjugate base of azlocillin (CHEBI:2956)
Incoming Relation(s)
azlocillin sodium (CHEBI:51864) has part azlocillin(1−) (CHEBI:51863)
azlocillin (CHEBI:2956) is conjugate acid of azlocillin(1−) (CHEBI:51863)
IUPAC Name 
2,2-dimethyl-6β-[(2R)-2-{[(2-oxoimidazolidin-1-yl)carbonyl]amino}-2-phenylacetamido]penam-3α-carboxylate
Synonym  Source
(2S,5R,6R)-3,3-dimethyl-7-oxo-6-{[(2R)-2-{[(2-oxoimidazolidin-1-yl)carbonyl]amino}-2-phenylacetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylateIUPAC
Registry NumbersSources
Beilstein:5683653Beilstein