Compound Identification
SMILES
COC1=C(CC=C(C)C)C(=C(CC=C(C)C)C(O)=C1N)C1=COC2=CC(O)=CC(O)=C2C1=O
InChIKey
InChIKey=FZVQFYVMVHEMPU-UHFFFAOYSA-N
Formula
C26H29NO6
Mass
451.519
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
Isoflav-2-enes
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Level 5
Isoflavones
- Level 6 2'-prenylated isoflavones
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Level 5
Isoflavones
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Subclass
Isoflav-2-enes
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-2-enes
Intermediate Tree Nodes
Isoflavones
Direct Parent
2'-prenylated isoflavones
Alternative Parents
3'-O-methylisoflavones Hydroxyisoflavonoids Chromones Methoxyphenols Aminophenyl ethers Methoxyanilines o-Aminophenols Anisoles Phenoxy compounds Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Heteroaromatic compounds Vinylogous acids Oxacyclic compounds Primary amines Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2'-prenylated isoflavone - 3p-methoxyisoflavone - Hydroxyisoflavonoid - Chromone - Methoxyphenol - 1-benzopyran - Benzopyran - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Aminophenol - Aniline or substituted anilines - Anisole - Methoxybenzene - Phenol ether - O-aminophenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Pyranone - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Benzenoid - Pyran - Monocyclic benzene moiety - Vinylogous acid - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Ether - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Primary amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2'-prenylated isoflavones. These are isoflavones featuring a C5-isoprenoid unit at the 2'-position.
External Descriptors
CHEBI:8251 :
substituted aniline - hydroxyisoflavone - methoxyisoflavone
LIPIDMAPS (LMPK12050157) :
Isoflavonoids
KEGG (C10518) :
isoflavones - Isoflavonoids