Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CCC(O)=O)C(O)=O.COC1=CC(OC)=C([C@H]2CCN(C)[C@@H]2CO)C2=C1C(=O)C=C(O2)C1=CC=CC=C1Cl

InChIKey

InChIKey=RSXNDVMFWCVMQI-LXUHHBSCSA-N

Formula

C28H33ClN2O9

Mass

577.03

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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

7-O-methylated flavonoids

Alternative Parents

Molecular Framework

Not available

Substituents

5-methoxyflavonoid-skeleton - 7-methoxyflavonoid-skeleton - Flavone - Glutamic acid or derivatives - Chromone - Benzopyran - 1-benzopyran - Alpha-amino acid or derivatives - Alpha-amino acid - L-alpha-amino acid - Phenol ether - Anisole - Alkyl aryl ether - Chlorobenzene - Aralkylamine - Halobenzene - Amino fatty acid - Pyranone - Fatty acyl - Fatty acid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - N-alkylpyrrolidine - Pyran - Vinylogous ester - Heteroaromatic compound - Pyrrolidine - Amino acid or derivatives - Amino acid - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organochloride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Primary amine - Organic oxide - Amine - Organic oxygen compound - Organohalogen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Primary aliphatic amine - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone.

External Descriptors

Not available

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