Compound Identification
SMILES
OC(=O)CCCCCCCOC1=CC2=C(C=C1)C(=O)C(=CO2)C1=CC=C(O)C=C1
InChIKey
InChIKey=JTBRNLMYWCCGGL-UHFFFAOYSA-N
Formula
C23H24O6
Mass
396.439
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
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Subclass
Isoflav-2-enes
- 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
Not available
Direct Parent
Isoflavones
Alternative Parents
Chromones Phenol ethers Medium-chain fatty acids Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Hydroxy fatty acids Alkyl aryl ethers Heterocyclic fatty acids Benzene and substituted derivatives Heteroaromatic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavone - Chromone - Benzopyran - 1-benzopyran - Phenol ether - Medium-chain fatty acid - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Heterocyclic fatty acid - Hydroxy fatty acid - Phenol - Pyranone - Pyran - Fatty acyl - Fatty acid - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.
External Descriptors
Not available