Compound Identification
SMILES
OC(=O)C1=CN(C2CC2)C2=CC(N3CCN(CC(=O)NC4=CC=C(C=C4)C(=O)\C=C\C4=CC=CC=C4Cl)CC3)=C(F)C=C2C1=O
InChIKey
InChIKey=LTZKLFLAUDWBMC-KPKJPENVSA-N
Formula
C34H30ClFN4O5
Mass
629.09
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
-
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
Quinoline carboxylic acids Fluoroquinolones Alpha amino acid amides N-arylpiperazines Haloquinolines Hydroquinolones Aminoquinolines and derivatives Hydroquinolines N-piperazineacetamides Anilides Pyridinecarboxylic acids Aryl ketones Benzoyl derivatives Dialkylarylamines Styrenes N-arylamides Chlorobenzenes N-alkylpiperazines Aryl chlorides Aryl fluorides Heteroaromatic compounds Vinylogous amides Enones Acryloyl compounds Secondary carboxylic acid amides Trialkylamines Amino acids Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Quinoline-3-carboxylic acid - Alpha-amino acid amide - N-arylpiperazine - Fluoroquinolone - Aminoquinoline - Haloquinoline - Dihydroquinolone - Dihydroquinoline - Quinoline - N-piperazineacetamide - Alpha-amino acid or derivatives - Anilide - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Dialkylarylamine - Aryl ketone - Tertiary aliphatic/aromatic amine - Styrene - N-arylamide - Benzoyl - N-alkylpiperazine - Halobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Pyridine - Acryloyl-group - Vinylogous amide - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Enone - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Ketone - Carboxamide group - Amino acid - Amino acid or derivatives - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Azacycle - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Organonitrogen compound - Organofluoride - Organochloride - 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