Compound Identification
SMILES
OC1=C(O)C(Cl)=CC(\C=C\C(=O)C2=C(Cl)C=C(Cl)C=C2)=C1
InChIKey
InChIKey=SOTHMOSMEQGDGS-DAFODLJHSA-N
Formula
C15H9Cl3O3
Mass
343.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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 Hydroxycinnamic acids and derivatives 3-chlorocatechols Styrenes O-chlorophenols M-chlorophenols Aryl ketones Benzoyl derivatives Dichlorobenzenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aryl chlorides Vinylogous halides Acryloyl compounds Enones Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamylphenol - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - 3-chlorocatechol - Chlorocatechol - Benzoyl - Catechol - 1,3-dichlorobenzene - 3-halophenol - 2-halophenol - 3-chlorophenol - 2-chlorophenol - Styrene - Aryl ketone - Chlorobenzene - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl chloride - Alpha,beta-unsaturated ketone - Vinylogous halide - Acryloyl-group - Enone - Ketone - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic oxygen compound - 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