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CHEBI:193975 - 2-methyl-3-phenyloxirane-2-carboxylic acid

ChEBI IDCHEBI:193975
ChEBI Name2-methyl-3-phenyloxirane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O3
Net Charge0
Average Mass178.187
Monoisotopic Mass178.06299
SMILESCC1(C(=O)O)OC1c1ccccc1
InChIInChI=1S/C10H10O3/c1-10(9(11)12)8(13-10)7-5-3-2-4-6-7/h2-6,8H,1H3,(H,11,12)
InChIKeyUPEAOFCHTFWNFG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-methyl-3-phenyloxirane-2-carboxylic acid (CHEBI:193975) is a carboxylic acid (CHEBI:33575)
2-methyl-3-phenyloxirane-2-carboxylic acid (CHEBI:193975) is a epoxide (CHEBI:32955)
IUPAC Name 
2-methyl-3-phenyloxirane-2-carboxylic acid
Manual XrefsDatabases
361768ChemSpider
Registry NumbersSources
CAS:25547-51-7ChemIDplus