Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC(=O)CC(C)C)C=CC(=C1)C1=C(OC)C(=O)C2=C(O)C=C(O)C=C2O1

InChIKey

InChIKey=ZQXNTAIEPXSPBP-UHFFFAOYSA-N

Formula

C22H22O8

Mass

414.41

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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 - 3p-methoxyflavonoid-skeleton - Hydroxyflavonoid - Flavone - 7-hydroxyflavonoid - 5-hydroxyflavonoid - 3-methoxychromone - Chromone - Benzopyran - 1-benzopyran - Phenol ester - Phenol ether - Methoxybenzene - Anisole - Phenoxy compound - Phenol - Alkyl aryl ether - Fatty acid ester - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Pyran - Vinylogous acid - Heteroaromatic compound - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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 (LMPK12112742) : Flavones and Flavonols

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