Compound Identification
SMILES
COC1=C(C=CC(O)=C1)C1(COC2=CC(O)=CC(O)=C2C1=O)OC
InChIKey
InChIKey=HHQWPZVIYIPHKV-UHFFFAOYSA-N
Formula
C17H16O7
Mass
332.308
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 3-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
3-O-methylated isoflavonoids
Alternative Parents
2'-O-methylated isoflavonoids Hydroxyisoflavonoids Isoflavanols Isoflavanones Chromones Methoxyphenols Benzylethers Anisoles Aryl alkyl ketones Phenoxy compounds Methoxybenzenes 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Vinylogous acids Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2p-methoxyisoflavonoid-skeleton - 3-methoxyisoflavonoid-skeleton - Isoflavanone - Isoflavanol - Hydroxyisoflavonoid - Isoflavan - Chromone - Benzopyran - Chromane - 1-benzopyran - Methoxyphenol - Benzylether - Anisole - Methoxybenzene - Phenoxy compound - Aryl alkyl ketone - Aryl ketone - Phenol ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Benzenoid - Monocyclic benzene moiety - Vinylogous acid - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen 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