Xanthohumol E (CHEBI:175258)

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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	Xanthohumol E

ChEBI ID	CHEBI:175258

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C25H26O5

Net Charge

Average Mass

406.478

Monoisotopic Mass

406.17802

InChI

InChI=1S/C25H26O5/c1-15(2)5-11-18-22(28)19-13-14-25(3,4)30-24(19)21(23(18)29)20(27)12-8-16-6-9-17(26)10-7-16/h5-10,12-14,26,28-29H,11H2,1-4H3/b12-8+

InChIKey

KRZGSPKDWYNTHE-XYOKQWHBSA-N

SMILES

O1C(C=CC=2C1=C(C(O)=C(C2O)CC=C(C)C)C(=O)/C=C/C3=CC=C(O)C=C3)(C)C

ChEBI Ontology
Outgoing	Xanthohumol E (CHEBI:175258) is a chalcones (CHEBI:23086)

IUPAC Name

(E)-1-[5,7-dihydroxy-2,2-dimethyl-6-(3-methylbut-2-enyl)chromen-8-yl]-3-(4-hydroxyphenyl)prop-2-en-1-one