Compound Identification
SMILES
CCCCCCCCC(OC1=CC(O)=C2C(OC=C(C2=O)C2=CC=C(OC)C=C2)=C1)C(=O)OC
InChIKey
InChIKey=WWGAKWQOXUCWDF-UHFFFAOYSA-N
Formula
C27H32O7
Mass
468.546
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
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Level 5
4'-O-methylated isoflavonoids
- Level 6 4'-O-methylisoflavones
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Level 5
4'-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
4'-O-methylated isoflavonoids
Direct Parent
4'-O-methylisoflavones
Alternative Parents
Hydroxyisoflavonoids Isoflavones Chromones Phenoxyacetic acid derivatives Methoxybenzenes Phenoxy compounds Anisoles 1-hydroxy-4-unsubstituted benzenoids Pyranones and derivatives Fatty acid esters 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Monosaccharides Methyl esters Vinylogous acids Heteroaromatic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4p-o-methylisoflavone - Isoflavone - Hydroxyisoflavonoid - Chromone - Phenoxyacetate - 1-benzopyran - Benzopyran - Phenol ether - Anisole - Methoxybenzene - Phenoxy compound - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Pyranone - 1-hydroxy-4-unsubstituted benzenoid - Fatty acid ester - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Pyran - Fatty acyl - Heteroaromatic compound - Vinylogous acid - Methyl ester - Carboxylic acid ester - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4'-o-methylisoflavones. These are isoflavones with methoxy groups attached to the C4' atom of the isoflavone backbone.
External Descriptors
Not available