Compound Identification
SMILES
COC1=C(C(=O)C2=C(O1)C=CC(=C2C1=CC=CC=C1)C(F)(F)F)C1=CC=C(O)C=C1
InChIKey
InChIKey=UZMSIPOTJGDLRL-UHFFFAOYSA-N
Formula
C23H15F3O4
Mass
412.364
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Isoflavonoids
-
Subclass
Isoflav-2-enes
- Level 5 Isoflavones
-
Subclass
Isoflav-2-enes
-
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
2-methoxychromones Coumarins and derivatives Pyranones and derivatives Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Vinylogous esters Heteroaromatic compounds Oxacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavone - 2-methoxychromone - Chromone - Coumarin - Benzopyran - 1-benzopyran - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyranone - Pyran - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous ester - Oxacycle - Organoheterocyclic compound - Ether - Organic oxide - Organic oxygen compound - Alkyl fluoride - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Organofluoride - 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