Amorfrutin A (CHEBI:195312)

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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	Amorfrutin A

ChEBI ID	CHEBI:195312

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H24O4

Net Charge

Average Mass

340.419

Monoisotopic Mass

340.16746

InChI

InChI=1S/C21H24O4/c1-14(2)9-12-17-18(25-3)13-16(19(20(17)22)21(23)24)11-10-15-7-5-4-6-8-15/h4-9,13,22H,10-12H2,1-3H3,(H,23,24)

InChIKey

CTNFTPUIYFUXBE-UHFFFAOYSA-N

SMILES

O(C1=C(C(O)=C(C(CCC2=CC=CC=C2)=C1)C(O)=O)CC=C(C)C)C

Metabolite of Species	Details
Radula complanata (NCBI:txid139838)	Found in whole plant (BTO:0001461). See: MetaboLights Study

ChEBI Ontology
Outgoing	Amorfrutin A (CHEBI:195312) is a stilbenoid (CHEBI:26776)

IUPAC Name

2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-(2-phenylethyl)benzoic acid