1-[2-hydroxy-4-(hydroxymethyl)phenyl]ethan-1-one (CHEBI:67435)

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ChEBI Name	1-[2-hydroxy-4-(hydroxymethyl)phenyl]ethan-1-one

ChEBI ID	CHEBI:67435

Definition	A natural product found in Eupatorium cannabinum subspecies asiaticum.

Stars	This entity has been manually annotated by a third party.

Supplier Information

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Formula

C9H10O3

Net Charge

Average Mass

166.17390

Monoisotopic Mass

166.06299

InChI

InChI=1S/C9H10O3/c1-6(11)8-3-2-7(5-10)4-9(8)12/h2-4,10,12H,5H2,1H3

InChIKey

CEKCNQSWPNISHG-UHFFFAOYSA-N

SMILES

CC(=O)c1ccc(CO)cc1O

Metabolite of Species	Details
Eupatorium cannabinum subsp. asiaticum (NCBI:txid102770)	Found in aerial part (BTO:0001658). MeOH extract of shade-dried, pulverized aerial parts See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	1-[2-hydroxy-4-(hydroxymethyl)phenyl]ethan-1-one (CHEBI:67435) has role metabolite (CHEBI:25212) 1-[2-hydroxy-4-(hydroxymethyl)phenyl]ethan-1-one (CHEBI:67435) is a acetophenones (CHEBI:22187)

Citation	Type	Source
21391659	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:carbonyl compound(CHEBI:36586); ISA:aromatic ketone(CHEBI:76224); ISA:phenols(CHEBI:33853); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enol(CHEBI:33823); ISA:polyol(CHEBI:26191); ISA:organonitrogen compound(CHEBI:35352); ISA:organic heterocyclic compound(CHEBI:24532); ISA:primary alcohol(CHEBI:15734); ISA:aromatic alcohol(CHEBI:33854);