Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=YFEOXGUEAFLJJM-UHFFFAOYSA-N

Formula

C18H16O11S

Mass

440.38

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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

6-O-methylated flavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3p-methoxyflavonoid-skeleton - 3-methoxyflavonoid-skeleton - 6-methoxyflavonoid-skeleton - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Flavone - Hydroxyflavonoid - 3-methoxychromone - Chromone - Phenylsulfate - Arylsulfate - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Pyranone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Sulfuric acid monoester - Pyran - Benzenoid - Sulfuric acid ester - Sulfate-ester - Monocyclic benzene moiety - Vinylogous acid - Organic sulfuric acid or derivatives - Heteroaromatic compound - Organoheterocyclic compound - Oxacycle - Ether - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone.

External Descriptors

LIPIDMAPS (LMPK12113033) : Flavones and Flavonols

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