Compound Identification
SMILES
CCCCCCCCCCOC1=CC=C(\C=C\C(=O)C2=CC=C(C=C2)N=CC2C(C)=NN(C2=O)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=KVNAPUWGPUVORA-DQWSATEYSA-N
Formula
C36H41N3O3
Mass
563.742
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 Styrenes Phenoxy compounds Phenol ethers Aryl ketones Benzoyl derivatives Alkyl aryl ethers Pyrazolones Acryloyl compounds Enones Shiff bases Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Benzoyl - Phenol ether - Styrene - Phenoxy compound - Aryl ketone - Alkyl aryl ether - Pyrazolinone - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Enone - Pyrazoline - Acryloyl-group - Shiff base - Ketone - Ether - Azacycle - Aldimine - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Imine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic 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