CHEBI:28054 - o-cresol

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ChEBI Name o-cresol ChEBI ID CHEBI:28054 ChEBI ASCII Name o-cresol Definition A cresol that is phenol substituted by a methyl group at position 2. It is a minor urinary metabolite of toluene. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:10609, CHEBI:25617 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C7H8O Net Charge 0 Average Mass 108.13780 Monoisotopic Mass 108.05751 InChI InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3 InChIKey QWVGKYWNOKOFNN-UHFFFAOYSA-N SMILES Cc1ccccc1O Roles Classification Biological Role(s): human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. fungicide A substance used to destroy fungal pests. (via aromatic fungicide ) Application(s): fungicide A substance used to destroy fungal pests. (via aromatic fungicide ) View more via ChEBI Ontology ChEBI Ontology Outgoing o-cresol (CHEBI:28054) has role human xenobiotic metabolite (CHEBI:76967) o-cresol (CHEBI:28054) is a cresol (CHEBI:25399) Incoming 1-(2-methylphenyl)glycerol (CHEBI:94398) has functional parent o-cresol (CHEBI:28054) 2-[(ethylsulfanyl)methyl]phenol (CHEBI:38487) has functional parent o-cresol (CHEBI:28054) 2-methylanisole (CHEBI:141702) has functional parent o-cresol (CHEBI:28054) 4,6-dinitro-o-cresol (CHEBI:39349) has functional parent o-cresol (CHEBI:28054) 4-chloro-2-methylphenol (CHEBI:1800) has functional parent o-cresol (CHEBI:28054) o-cresol hydrogen sulfate (CHEBI:133089) has functional parent o-cresol (CHEBI:28054) IUPAC Name 2-methylphenol Synonyms Sources 1-hydroxy-2-methylbenzene ChemIDplus 2-cresol ChemIDplus 2-hydroxy-1-methylbenzene ChemIDplus 2-Hydroxytoluene KEGG COMPOUND 2-hydroxytoluene UniProt 2-hydroxytoluene ChemIDplus o-Cresol KEGG COMPOUND o-cresylic acid ChemIDplus o-Kresol NIST Chemistry WebBook o-Methylphenol KEGG COMPOUND ortho-cresol ChemIDplus orthocresol ChemIDplus Manual Xrefs Databases C00030878 KNApSAcK C01542 KEGG COMPOUND c0281 UM-BBD HMDB0002055 HMDB JZ0 PDBeChem O-Cresol Wikipedia View more database links Registry Numbers Types Sources 101619 Gmelin Registry Number Gmelin 506917 Reaxys Registry Number Reaxys 506917 Beilstein Registry Number Beilstein 95-48-7 CAS Registry Number ChemIDplus 95-48-7 CAS Registry Number NIST Chemistry WebBook Citation Type Source 15687000 PubMed citation Europe PMC Last Modified 21 August 2018