CHEBI:51350 - cloxacillin(1−)

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ChEBI Name cloxacillin(1−)
ChEBI ID CHEBI:51350
ChEBI ASCII Name cloxacillin(1-)
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H17ClN3O5S
Net Charge -1
Average Mass 434.87300
Monoisotopic Mass 434.05829
InChI InChI=1S/C19H18ClN3O5S/c1-8-11(12(22-28-8)9-6-4-5-7-10(9)20)15(24)21-13-16(25)23-14(18(26)27)19(2,3)29-17(13)23/h4-7,13-14,17H,1-3H3,(H,21,24)(H,26,27)/p-1/t13-,14+,17-/m1/s1
InChIKey LQOLIRLGBULYKD-JKIFEVAISA-M
SMILES [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)c1c(C)onc1-c1ccccc1Cl)C([O-])=O
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
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ChEBI Ontology
Outgoing cloxacillin(1−) (CHEBI:51350) is a penicillinate anion (CHEBI:51356)
cloxacillin(1−) (CHEBI:51350) is conjugate base of cloxacillin (CHEBI:49566)
Incoming cloxacillin benzathine (CHEBI:51351) has part cloxacillin(1−) (CHEBI:51350)
cloxacillin sodium (CHEBI:51357) has part cloxacillin(1−) (CHEBI:51350)
cloxacillin (CHEBI:49566) is conjugate acid of cloxacillin(1−) (CHEBI:51350)
IUPAC Name
2,2-dimethyl-6β-({[5-methyl-3-(2-chlorophenyl)isoxazol-4-yl]carbonyl}amino)penam-3α-carboxylate
Registry Number Type Source
5406065 Beilstein Registry Number Beilstein
Last Modified
28 March 2011