3-isopentyl-4-hydroxy phenylacetic acid methyl ester (CHEBI:217345)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3-isopentyl-4-hydroxy phenylacetic acid methyl ester

ChEBI ID	CHEBI:217345

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

Submitter	MetaboLights

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Formula

C14H18O3

Net Charge

Average Mass

234.295

Monoisotopic Mass

234.12559

InChI

InChI=1S/C14H18O3/c1-10(2)4-6-12-8-11(5-7-13(12)15)9-14(16)17-3/h4-5,7-8,15H,6,9H2,1-3H3

InChIKey

RTXQUMJZISQWEA-UHFFFAOYSA-N

SMILES

O=C(OC)CC1=CC(=C(O)C=C1)CC=C(C)C

Metabolite of Species	Details
Penicillium (NCBI:txid5073)	See: PubMed

ChEBI Ontology
Outgoing	3-isopentyl-4-hydroxy phenylacetic acid methyl ester (CHEBI:217345) is a phenols (CHEBI:33853)

IUPAC Name

methyl 2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]acetate