Compound Identification
SMILES
COC1=C(OC)C(OC)=C2OC[C@@H]([C@@H](O)C2=C1)C1=CC(O)=C(OC)C(OC)=C1O
InChIKey
InChIKey=NBOVJURIMDHEEI-RISCZKNCSA-N
Formula
C20H24O9
Mass
408.403
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 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
4'-O-methylated isoflavonoids
Direct Parent
3'-hydroxy,4'-methoxyisoflavonoids
Alternative Parents
3'-O-methylated isoflavonoids 6-O-methylated isoflavonoids 7-O-methylated isoflavonoids 8-O-methylated isoflavonoids Isoflavanols Hydroxyisoflavonoids Ubiquinols 1-benzopyrans Methoxyphenols Dimethoxybenzenes Anisoles Phenoxy compounds Hydroquinones Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Secondary alcohols Oxacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3'-hydroxy,4'-methoxyisoflavonoid - 3p-methoxyisoflavonoid-skeleton - 6-methoxyisoflavonoid-skeleton - 7-methoxyisoflavonoid-skeleton - 8-methoxyisoflavonoid-skeleton - Hydroxyisoflavonoid - Isoflavanol - Isoflavan - Ubiquinol skeleton - Chromane - Benzopyran - O-dimethoxybenzene - Dimethoxybenzene - 1-benzopyran - Methoxyphenol - Phenoxy compound - Anisole - Methoxybenzene - Hydroquinone - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Secondary alcohol - Organoheterocyclic compound - Ether - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3'-hydroxy,4'-methoxyisoflavonoids. These are isoflavonoids carrying a methoxy group attached to the C4' atom, as well as a hydroxyl group at the C3'-position of the isoflavonoid backbone.
External Descriptors
Not available