Compound Identification
SMILES
COC1(OC)Oc2ccccc2CC1(OC)c1ccccc1
InChIKey
InChIKey=USKPEUNHCLQBDX-UHFFFAOYSA-N
Formula
C18H20O4
Mass
300.354
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
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Subclass
O-methylated isoflavonoids
- Level 5 3-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
3-O-methylated isoflavonoids
Alternative Parents
2-O-methylated isoflavonoids Isoflavans 1-benzopyrans Benzylethers Ortho esters Carboxylic acid orthoesters Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-methoxyisoflavonoid-skeleton - 2-methoxyisoflavonoid-skeleton - Isoflavan - 1-benzopyran - Benzopyran - Chromane - Benzylether - Ortho ester - Carboxylic acid orthoester - Benzenoid - Monocyclic benzene moiety - Orthocarboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C3 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available