Compound Identification
SMILES
CC1=C(C(=O)OC2=CC=C(C=C2)C(=O)C=CC2=C(Cl)C=CC=C2Cl)C2=C(O1)C=CC(OCC1=CC=CC=C1)=C2
InChIKey
InChIKey=SFRVFKJJNJRLKA-UHFFFAOYSA-N
Formula
C32H22Cl2O5
Mass
557.42
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
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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 Phenol esters Benzofurans Furoic acid esters Aryl ketones Styrenes Benzoyl derivatives Phenoxy compounds Dichlorobenzenes Furan-3-carboxylic acid esters Alkyl aryl ethers Aryl chlorides Enones Acryloyl compounds Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Aldehydes Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Phenol ester - Furoic acid ester - Benzofuran - Furoic acid or derivatives - Furan-3-carboxylic acid ester - Furan-3-carboxylic acid or derivatives - Phenoxy compound - 1,3-dichlorobenzene - Benzoyl - Aryl ketone - Styrene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Enone - Heteroaromatic compound - Acryloyl-group - Alpha,beta-unsaturated ketone - Furan - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organooxygen compound - Aldehyde - Organic oxygen compound - Organochloride - Organic oxide - Organohalogen compound - Hydrocarbon derivative - 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