2-(2-acetyl-3,5-dihydroxyphenyl)acetic acid (CHEBI:183480)

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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-acetyl-3,5-dihydroxyphenyl)acetic acid

ChEBI ID	CHEBI:183480

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H10O5

Net Charge

Average Mass

210.185

Monoisotopic Mass

210.05282

InChI

InChI=1S/C10H10O5/c1-5(11)10-6(3-9(14)15)2-7(12)4-8(10)13/h2,4,12-13H,3H2,1H3,(H,14,15)

InChIKey

JAHPPWGWEUVLMS-UHFFFAOYSA-N

SMILES

OC=1C(=C(CC(O)=O)C=C(O)C1)C(=O)C

Metabolite of Species	Details
Bombus terrestris (NCBI:txid30195)	Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hindgut (BTO:0000510). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hemolymph (BTO:0000572). See: MetaboLights Study

ChEBI Ontology
Outgoing	2-(2-acetyl-3,5-dihydroxyphenyl)acetic acid (CHEBI:183480) is a aromatic ketone (CHEBI:76224)

IUPAC Name

2-(2-acetyl-3,5-dihydroxyphenyl)acetic acid