Hamilcone (CHEBI:168804)

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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	Hamilcone

ChEBI ID	CHEBI:168804

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H18O7

Net Charge

Average Mass

346.335

Monoisotopic Mass

346.10525

InChI

InChI=1S/C18H18O7/c1-23-15-9-14(22)16(18(25-3)17(15)24-2)12(20)7-5-10-4-6-11(19)13(21)8-10/h4-9,19,21-22H,1-3H3/b7-5+

InChIKey

ZORDSTUSHFTNGS-FNORWQNLSA-N

SMILES

O(C1=C(C(O)=CC(OC)=C1OC)C(=O)/C=C/C2=CC(O)=C(O)C=C2)C

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	Hamilcone (CHEBI:168804) is a chalcones (CHEBI:23086)

IUPAC Name

(E)-3-(3,4-dihydroxyphenyl)-1-(6-hydroxy-2,3,4-trimethoxyphenyl)prop-2-en-1-one