Compound Identification
SMILES
CC(C)OC(=O)[C@](F)([C@@H](C[N+]([O-])=O)C1=CC=CC=C1)C(=O)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=DLSPSEDPVQIDCS-PXNSSMCTSA-N
Formula
C20H19ClFNO5
Mass
407.82
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
Subclass
Chalcones and dihydrochalcones
- Level 5 Retro-dihydrochalcones
-
Subclass
Chalcones and dihydrochalcones
-
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 Phenylbutylamines Butyrophenones Aryl alkyl ketones Benzoyl derivatives Beta-keto acids and derivatives Chlorobenzenes Fatty acid esters Aryl chlorides Alpha-halocarboxylic acid derivatives Alpha-haloketones Carboxylic acid esters C-nitro compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organochlorides Alkyl fluorides Organofluorides Organonitrogen compounds Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Phenylbutylamine - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Fatty acid ester - Halobenzene - Chlorobenzene - Beta-keto acid - Keto acid - Aryl chloride - Aryl halide - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Organic nitro compound - Carboxylic acid ester - Ketone - C-nitro compound - Carboxylic acid derivative - Organic oxoazanium - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Alkyl fluoride - Alkyl halide - Organohalogen compound - Organochloride - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic homomonocyclic 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