Compound Identification
SMILES
COC1=CC(OCC2=CC=CC=C2)=C(C=C1)C1(OC)C(O)OC2=C(C=CC(OCC3=CC=CC=C3)=C2)C1=O
InChIKey
InChIKey=VXLWDXLSYIITGF-UHFFFAOYSA-N
Formula
C31H28O7
Mass
512.558
Taxonomic Classification
Taxonomy Tree
-
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 4'-O-methylated isoflavonoids
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Subclass
O-methylated isoflavonoids
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Class
Isoflavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
O-methylated isoflavonoids
Intermediate Tree Nodes
Not available
Direct Parent
4'-O-methylated isoflavonoids
Alternative Parents
3-O-methylated isoflavonoids 2-hydroxyisoflavanones Isoflavanols Hydroxyisoflavonoids Chromones Benzylethers Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Alkyl aryl ethers Hemiacetals Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-methoxyisoflavonoid-skeleton - 4p-methoxyisoflavonoid - 2-hydroxyisoflavanone - Hydroxyisoflavonoid - Isoflavanol - Isoflavanone - Isoflavan - Chromone - Chromane - Benzopyran - 1-benzopyran - Benzylether - Aryl alkyl ketone - Phenol ether - Aryl ketone - Methoxybenzene - Phenoxy compound - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Ketone - Hemiacetal - Organoheterocyclic compound - Oxacycle - Ether - Dialkyl ether - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4'-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C4' atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available