Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1CC2=C(OC(C)=O)C(OC)=C(OC)C=C2OC1OC(C)=O
InChIKey
InChIKey=JJZGXHQUFWLAMK-UHFFFAOYSA-N
Formula
C23H26O9
Mass
446.452
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Isoflavonoids
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Subclass
O-methylated isoflavonoids
- Level 5 7-O-methylated isoflavonoids
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Subclass
O-methylated isoflavonoids
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
O-methylated isoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
7-O-methylated isoflavonoids
Alternative Parents
3'-O-methylated isoflavonoids 4'-O-methylated isoflavonoids 6-O-methylated isoflavonoids Isoflavans 1-benzopyrans Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Dicarboxylic acids and derivatives Carboxylic acid esters Acetals Oxacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3p-methoxyisoflavonoid-skeleton - 4p-methoxyisoflavonoid - 6-methoxyisoflavonoid-skeleton - 7-methoxyisoflavonoid-skeleton - Isoflavan - O-dimethoxybenzene - Dimethoxybenzene - Benzopyran - 1-benzopyran - Chromane - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Carboxylic acid ester - Oxacycle - Acetal - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 7-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C7 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available