Citrunobin (CHEBI:175512)

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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	Citrunobin

ChEBI ID	CHEBI:175512

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H20O5

Net Charge

Average Mass

352.386

Monoisotopic Mass

352.13107

InChI

InChI=1S/C21H20O5/c1-21(2)11-10-15-18(25-3)12-17(24)19(20(15)26-21)16(23)9-6-13-4-7-14(22)8-5-13/h4-12,22,24H,1-3H3/b9-6+

InChIKey

RPGWAGOTDRYEAD-RMKNXTFCSA-N

SMILES

O1C(C=CC=2C1=C(C(O)=CC2OC)C(=O)/C=C/C3=CC=C(O)C=C3)(C)C

ChEBI Ontology
Outgoing	Citrunobin (CHEBI:175512) is a chalcones (CHEBI:23086)

IUPAC Name

(E)-1-(7-hydroxy-5-methoxy-2,2-dimethylchromen-8-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one