Compound Identification
SMILES
OC(=O)COC1=CC=C(C=CC(=O)C2=C(Cl)C=C(Cl)C=C2)C=C1
InChIKey
InChIKey=SAEWFCHLBHDAKU-UHFFFAOYSA-N
Formula
C17H12Cl2O4
Mass
351.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
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 Phenoxyacetic acid derivatives Aryl ketones Benzoyl derivatives Dichlorobenzenes Phenol ethers Phenoxy compounds Styrenes Alkyl aryl ethers Aryl chlorides Enones Vinylogous halides Acryloyl compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Phenoxyacetate - 1,3-dichlorobenzene - Phenoxy compound - Benzoyl - Phenol ether - Styrene - Aryl ketone - Chlorobenzene - Alkyl aryl ether - Halobenzene - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Vinylogous halide - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Ether - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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