Compound Identification
SMILES
COc1cc(OC)c(cc1OC)C1COc2c(C1)cccc2OC
InChIKey
InChIKey=IVSCWQXGUUHBSX-UHFFFAOYSA-N
Formula
C19H22O5
Mass
330.38
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 8-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
8-O-methylated isoflavonoids
Alternative Parents
4'-O-methylated isoflavonoids 3'-O-methylated isoflavonoids 2'-O-methylated isoflavonoids Isoflavanols 1-benzopyrans Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Oxacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
8-methoxyisoflavonoid-skeleton - 4p-methoxyisoflavonoid - 3p-methoxyisoflavonoid-skeleton - 2p-methoxyisoflavonoid-skeleton - Isoflavanol - Isoflavan - 1-benzopyran - Benzopyran - Chromane - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 8-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C8 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available