Compound Identification
SMILES
C1CCC(CC1)[NH2+]C1CCCCC1.[O-]C1=CC2=C(C=C1)C(=O)C(=CO2)C1=CC=CC=C1
InChIKey
InChIKey=OBVZTDLVBOJIDS-UHFFFAOYSA-N
Formula
C27H33NO3
Mass
419.565
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
-
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 Pyranones and derivatives Phenoxides Cyclohexylamines Quaternary ammonium salts Heteroaromatic compounds Oxacyclic compounds Dialkylamines Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Isoflavone - Chromone - Benzopyran - 1-benzopyran - Cyclohexylamine - Phenoxide - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Quaternary ammonium salt - Secondary aliphatic amine - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organic cation - 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