Compound Identification
SMILES
ClC1=CC=CC(=C1)C(=O)C(=C\C1=CC=C(OCCN2CCCC2)C=C1)\C1=CC=CC=C1
InChIKey
InChIKey=LBQLAZYELRMMAE-LGUFXXKBSA-N
Formula
C27H26ClNO2
Mass
431.96
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
Stilbenes Cinnamic acids and derivatives Styrenes Phenoxy compounds Phenol ethers Aryl ketones Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Alpha-branched alpha,beta-unsaturated ketones Aryl chlorides N-alkylpyrrolidines Acryloyl compounds Enones Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Stilbene - Cinnamic acid or derivatives - Benzoyl - Phenol ether - Phenoxy compound - Styrene - Aryl ketone - Halobenzene - Chlorobenzene - Alkyl aryl ether - Aryl chloride - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - Aryl halide - Alpha-branched alpha,beta-unsaturated-ketone - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Ketone - Ether - Azacycle - Organoheterocyclic compound - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - 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