Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C(O)C1COC2=CC3=C(C=C2C1=O)C(C)(C)CCC3(C)C
InChIKey
InChIKey=KSFYRUAHYXQHBB-UHFFFAOYSA-N
Formula
C26H30O5
Mass
422.521
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Homoisoflavonoids
-
Subclass
Homoisoflavans
- Level 5 Homoisoflavanones
-
Subclass
Homoisoflavans
-
Class
Homoisoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Homoisoflavonoids
Subclass
Homoisoflavans
Intermediate Tree Nodes
Not available
Direct Parent
Homoisoflavanones
Alternative Parents
Naphthopyrans Chromones Tetralins Naphthalenes Benzoic acid esters Benzoyl derivatives Aryl alkyl ketones Alkyl aryl ethers Pyrans Methyl esters Secondary alcohols Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Homoisoflavanone - Naphthopyran - Chromone - Benzoate ester - Chromane - Benzopyran - Naphthalene - Tetralin - 1-benzopyran - Benzoic acid or derivatives - Benzoyl - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Pyran - Benzenoid - Monocyclic benzene moiety - Methyl ester - Secondary alcohol - Ketone - Carboxylic acid ester - Ether - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Alcohol - Aromatic alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as homoisoflavanones. These are homoisoflavonoids with a structure based on the chromanone system. Chromanone is a bicyclic compound consisting of a 3,4-dihydro-1-benzopyran, which bears a ketone group at the 4-position.
External Descriptors
Not available