CHEBI:31379 - cefroxadine

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ChEBI Name cefroxadine
ChEBI ID CHEBI:31379
Definition A first-generation cephalosporin antibiotic having methoxy and [(2R)-2-amino-2-(cyclohexa-1,4-dien-1-yl)acetyl]amino side groups located at positions 3 and 7 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H19N3O5S
Net Charge 0
Average Mass 365.406
Monoisotopic Mass 365.10454
InChI InChI=1S/C16H19N3O5S/c1-24-9-7-25-15-11(14(21)19(15)12(9)16(22)23)18-13(20)10(17)8-5-3-2-4-6-8/h2-3,6,10-11,15H,4-5,7,17H2,1H3,(H,18,20)(H,22,23)/t10-,11-,15-/m1/s1
InChIKey RDMOROXKXONCAL-UEKVPHQBSA-N
SMILES [C@]12(N(C(=C(CS1)OC)C(=O)O)C([C@H]2NC(=O)[C@@H](C=3CC=CCC3)N)=O)[H]
Roles Classification
Biological Role(s): drug allergen
Any drug which causes the onset of an allergic reaction.
(via cephalosporin )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via heterocyclic antibiotic )
Application(s): drug allergen
Any drug which causes the onset of an allergic reaction.
(via cephalosporin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cefroxadine (CHEBI:31379) is a cephalosporin (CHEBI:23066)
IUPAC Name
7-{[(2R)-2-amino-2-(cyclohexa-1,4-dien-1-yl)acetyl]amino}-3-methoxy-3,4-didehydrocepham-4-carboxylic acid
INNs Sources
cefroxadine ChemIDplus
céfroxadine ChemIDplus
cefroxadino ChemIDplus
cefroxadinum ChemIDplus
Synonyms Sources
(6R,7R)-7-{[(2R)-2-amino-2-(cyclohexa-1,4-dien-1-yl)acetyl]amino}-3-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC
CXD KEGG DRUG
Manual Xrefs Databases
557 DrugCentral
C12979 KEGG COMPOUND
Cefroxadine Wikipedia
D01528 KEGG DRUG
View more database links
Registry Numbers Types Sources
51762-05-1 CAS Registry Number KEGG COMPOUND
8165480 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
2258253 PubMed citation Europe PMC
29017833 PubMed citation Europe PMC
6752462 PubMed citation Europe PMC
7334594 PubMed citation Europe PMC
Last Modified
14 March 2018