Compound Identification
SMILES
CC1=C(C(=O)OC2=C1C=CC(OCC(=O)C1=CC=CC=C1)=C2)C1=CC=CC=C1
InChIKey
InChIKey=HLKGRSMXZLEFKD-UHFFFAOYSA-N
Formula
C24H18O4
Mass
370.404
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
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Subclass
Isoflav-3-enes
- Level 5 Isoflav-3-enones
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Subclass
Isoflav-3-enes
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-3-enes
Intermediate Tree Nodes
Not available
Direct Parent
Isoflav-3-enones
Alternative Parents
Alkyl-phenylketones Coumarins and derivatives 1-benzopyrans Phenol ethers Benzoyl derivatives Aryl alkyl ketones Pyranones and derivatives Alkyl aryl ethers Heteroaromatic compounds Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflav-3-enone skeleton - Alkyl-phenylketone - Coumarin - 1-benzopyran - Benzopyran - Phenylketone - Phenol ether - Aryl ketone - Aryl alkyl ketone - Benzoyl - Pyranone - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyran - Heteroaromatic compound - Lactone - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflav-3-enones. These are flavonoids with a structure based on an isoflav-3-ene skeleton bearing an oxo-group at position C2.
External Descriptors
Not available