2-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-2-hydroxyacetic acid (CHEBI:168332)

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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	2-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-2-hydroxyacetic acid

ChEBI ID	CHEBI:168332

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H16O5

Net Charge

Average Mass

252.266

Monoisotopic Mass

252.09977

InChI

InChI=1S/C13H16O5/c1-7(2)3-4-8-10(14)6-5-9(11(8)15)12(16)13(17)18/h3,5-6,12,14-16H,4H2,1-2H3,(H,17,18)

InChIKey

DXWQLQYAZXDPDF-UHFFFAOYSA-N

SMILES

OC=1C(CC=C(C)C)=C(O)C=CC1C(O)C(O)=O

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

ChEBI Ontology
Outgoing	2-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-2-hydroxyacetic acid (CHEBI:168332) is a resorcinols (CHEBI:33572)

IUPAC Name

2-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-2-hydroxyacetic acid