Compound Identification
SMILES
COC1=CC(C=CC(=O)C2=CC=C(NC3=C4C=CC(Cl)=CC4=NC=C3)C=C2)=CC(OC)=C1OC
InChIKey
InChIKey=FKOHVLWILWYUBV-UHFFFAOYSA-N
Formula
C27H23ClN2O4
Mass
474.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
-
Subclass
Chalcones and dihydrochalcones
-
Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retrochalcones
Alternative Parents
Cinnamic acids and derivatives 4-aminoquinolines Chloroquinolines Styrenes Aniline and substituted anilines Anisoles Aryl ketones Benzoyl derivatives Methoxybenzenes Phenoxy compounds Aminopyridines and derivatives Alkyl aryl ethers Primary aromatic amines Aryl chlorides Acryloyl compounds Enones Heteroaromatic compounds Secondary amines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Aminoquinoline - 4-aminoquinoline - Haloquinoline - Chloroquinoline - Quinoline - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Styrene - Aryl ketone - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Aminopyridine - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Primary aromatic amine - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Ketone - Ether - Secondary amine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available