Compound Identification
SMILES
ClC1=NC2=CC=CC=C2C=C1COC1=CC=CC=C1C=CC(=O)C1=CC=CC=C1
InChIKey
InChIKey=LUNLPSGDPCWGTC-UHFFFAOYSA-N
Formula
C25H18ClNO2
Mass
399.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
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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 Chloroquinolines Styrenes Phenoxy compounds Phenol ethers Aryl ketones Benzoyl derivatives 2-halopyridines Alkyl aryl ethers Aryl chlorides Acryloyl compounds Heteroaromatic compounds Enones Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Chloroquinoline - Haloquinoline - Quinoline - Styrene - Benzoyl - Phenoxy compound - Phenol ether - Aryl ketone - Alkyl aryl ether - 2-halopyridine - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Aryl chloride - Acryloyl-group - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - Ketone - Ether - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen 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