Compound Identification
SMILES
OC1=CC=C(C=C1)C(=O)C(=CC1=CC(Cl)=C(Cl)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=ADTDTVFNQISXTE-UHFFFAOYSA-N
Formula
C21H14Cl2O2
Mass
369.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Cinnamylphenols Stilbenes Cinnamic acids and derivatives Styrenes Dichlorobenzenes Benzoyl derivatives Aryl ketones 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Alpha-branched alpha,beta-unsaturated ketones Enones Acryloyl compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamylphenol - Stilbene - Cinnamic acid or derivatives - Benzoyl - 1,2-dichlorobenzene - Styrene - Aryl ketone - Chlorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Phenol - Benzenoid - Aryl halide - Alpha-branched alpha,beta-unsaturated-ketone - Monocyclic benzene moiety - Aryl chloride - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - Ketone - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic 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