3'-Angeloyloxy-4',6'-dihydroxy-2',5'-dimethoxychalcone (CHEBI:178245)

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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	3'-Angeloyloxy-4',6'-dihydroxy-2',5'-dimethoxychalcone

ChEBI ID	CHEBI:178245

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C22H22O7

Net Charge

Average Mass

398.411

Monoisotopic Mass

398.13655

InChI

InChI=1S/C22H22O7/c1-5-13(2)22(26)29-21-18(25)20(28-4)17(24)16(19(21)27-3)15(23)12-11-14-9-7-6-8-10-14/h5-12,24-25H,1-4H3/b12-11+,13-5-

InChIKey

VAKBZJXPGKSDQT-BDVHTTMESA-N

SMILES

O(C1=C(OC)C(=C(O)C(OC)=C1O)C(=O)/C=C/C2=CC=CC=C2)C(=O)/C(/C)=C\C

ChEBI Ontology
Outgoing	3'-Angeloyloxy-4',6'-dihydroxy-2',5'-dimethoxychalcone (CHEBI:178245) is a chalcones (CHEBI:23086)

IUPAC Name

[2,4-dihydroxy-3,6-dimethoxy-5-[(E)-3-phenylprop-2-enoyl]phenyl] (Z)-2-methylbut-2-enoate