Compound Identification
SMILES
CCOC(=O)C1=C(NC(CC(=O)C2=CC=CC=C2)C2=CC=CC=C2)C2=C(Cl)C=C(Cl)C=C2N1C(=O)OC(C)(C)C
InChIKey
InChIKey=IDQOLUVOIQAXRE-UHFFFAOYSA-N
Formula
C31H30Cl2N2O5
Mass
581.49
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 Retro-dihydrochalcones
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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
Retro-dihydrochalcones
Alternative Parents
Alkyl-phenylketones Indolecarboxylic acids Butyrophenones Indoles Pyrrole carboxylic acids and derivatives Aryl alkyl ketones Benzoyl derivatives Secondary alkylarylamines Aralkylamines Substituted pyrroles Beta-amino ketones Aryl chlorides Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Indolecarboxylic acid derivative - Indolecarboxylic acid - Butyrophenone - Indole or derivatives - Indole - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-1-carboxylic acid or derivatives - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Aryl halide - Substituted pyrrole - Aryl chloride - Beta-aminoketone - Vinylogous amide - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Ketone - Secondary amine - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available