Mesuagin (CHEBI:166644)

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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	Mesuagin

ChEBI ID	CHEBI:166644

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C24H22O5

Net Charge

Average Mass

390.435

Monoisotopic Mass

390.14672

InChI

InChI=1S/C24H22O5/c1-13(2)20(26)19-21(27)18-16(14-8-6-5-7-9-14)12-17(25)28-22(18)15-10-11-24(3,4)29-23(15)19/h5-13,27H,1-4H3

InChIKey

SVCPILBFQWTZFW-UHFFFAOYSA-N

SMILES

O1C(C=CC=2C1=C(C(O)=C3C2OC(=O)C=C3C4=CC=CC=C4)C(=O)C(C)C)(C)C

ChEBI Ontology
Outgoing	Mesuagin (CHEBI:166644) is a neoflavonoid (CHEBI:71971)

IUPAC Name

5-hydroxy-8,8-dimethyl-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-h]chromen-2-one