Compound Identification
SMILES
CCOC(=O)C(C(CN)C1=CC=CC2=CC=CC=C12)C(=O)C1=CC=C(OC)C=C1
InChIKey
InChIKey=BLAWRCKPWMNQSB-UHFFFAOYSA-N
Formula
C24H25NO4
Mass
391.467
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
-
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 Gamma amino acids and derivatives Phenylbutylamines Butyrophenones Naphthalenes Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Aralkylamines Beta-keto acids and derivatives Fatty acid esters 1,3-dicarbonyl compounds Gamma-amino ketones Carboxylic acid esters Monocarboxylic acids and derivatives Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Gamma amino acid or derivatives - Butyrophenone - Phenylbutylamine - Naphthalene - Phenylketone - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Beta-keto acid - Fatty acid ester - 1,3-dicarbonyl compound - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Keto acid - Gamma-aminoketone - Carboxylic acid ester - Ketone - Amino acid or derivatives - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxide - Primary aliphatic amine - Aromatic homopolycyclic 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