Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC2=C(C(O)=CC(O)=C2OC(=O)C(\C)=C\C)C1=O)C1=CC=CC=C1

InChIKey

InChIKey=RRKFFDGUNSJFHI-NYYWCZLTSA-N

Formula

C21H18O7

Mass

382.368

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

O-methylated flavonoids

Intermediate Tree Nodes

Not available

Direct Parent

3-O-methylated flavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-methoxyflavonoid-skeleton - Hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavone - 3-methoxychromone - Chromone - Phenol ester - 1-benzopyran - Benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Pyranone - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Pyran - Benzenoid - Heteroaromatic compound - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C3 atom of the flavonoid backbone.

External Descriptors

LIPIDMAPS (LMPK12113081) : Flavones and Flavonols

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