Compound Identification
SMILES
COC1=C(C=C(O)C=C1)C1=C(C)C2=C(O[C@@H]1C1=CC=C(OC[C@H](C)N3CC[C@@H](C)C3)C=C1)C=CC(O)=C2
InChIKey
InChIKey=MNVKPEJFZONEPG-JQNAMAILSA-N
Formula
C31H35NO5
Mass
501.623
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 2'-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
2'-O-methylated isoflavonoids
Alternative Parents
6-hydroxyflavonoids Hydroxyisoflavonoids Isoflav-3-enes Flav-3-enes Stilbenes 1-benzopyrans Methoxyphenols 4-alkoxyphenols Phenoxy compounds Methoxybenzenes Anisoles 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers N-alkylpyrrolidines Trialkylamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2p-methoxyisoflavonoid-skeleton - 6-hydroxyflavonoid - Hydroxyflavonoid - Hydroxyisoflavonoid - Isoflav-3-ene skeleton - Flav-3-ene - Stilbene - Benzopyran - Methoxyphenol - 1-benzopyran - 4-alkoxyphenol - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Phenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2'-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C2' atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one.
External Descriptors
Not available