Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)C1OC2=CC(OC)=CC(OC)=C2C(=O)C1OC(C)=O
InChIKey
InChIKey=JTHVOGPDDBAEJZ-UHFFFAOYSA-N
Formula
C21H22O8
Mass
402.399
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
-
Subclass
O-methylated flavonoids
- Level 5 7-O-methylated flavonoids
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Subclass
O-methylated flavonoids
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
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
2'-O-methylated flavonoids 4'-O-methylated flavonoids 5-O-methylated flavonoids Flavanonols Chromones Dimethoxybenzenes Phenoxy compounds Anisoles Aryl alkyl ketones Alkyl aryl ethers Alpha-acyloxy ketones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2p-methoxyflavonoid-skeleton - 4p-methoxyflavonoid-skeleton - 5-methoxyflavonoid-skeleton - 7-methoxyflavonoid-skeleton - Flavanone - Flavanonol - Flavan - Chromone - Benzopyran - M-dimethoxybenzene - Dimethoxybenzene - Chromane - 1-benzopyran - Methoxybenzene - Phenol ether - Anisole - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Alpha-acyloxy ketone - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Ketone - Carboxylic acid ester - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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