Compound Identification
SMILES
CNC1=CC=CC=C1C(=O)\C=C\C1=CC(OC)=C(OC)C=C1OC
InChIKey
InChIKey=WCZRHDVUKSERLU-MDZDMXLPSA-N
Formula
C19H21NO4
Mass
327.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
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
Cinnamic acids and derivatives Aniline and substituted anilines Anisoles Aryl ketones Benzoyl derivatives Methoxybenzenes Phenoxy compounds Phenylalkylamines Styrenes Alkyl aryl ethers Secondary alkylarylamines Acryloyl compounds Vinylogous amides Enones Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Anisole - Benzoyl - Phenol ether - Styrene - Phenoxy compound - Aryl ketone - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Enone - Acryloyl-group - Vinylogous amide - Alpha,beta-unsaturated ketone - Ketone - Secondary amine - Ether - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic 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