Compound Identification
SMILES
COC(=O)C1=CC=C(C=CC(=O)C2=CC=C(OC(=O)N3CCOCC3)C=C2)C=C1
InChIKey
InChIKey=ZIWXZOMMXYEOAQ-UHFFFAOYSA-N
Formula
C22H21NO6
Mass
395.411
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
-
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
Retrochalcones
Alternative Parents
Cinnamic acids and derivatives Benzoic acid esters Morpholine carboxylic acids Styrenes Phenoxy compounds Aryl ketones Benzoyl derivatives Acryloyl compounds Carbamate esters Methyl esters Enones Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Benzoate ester - Morpholine-4-carboxylic acid or derivatives - Morpholine-4-carboxylic acid - Benzoic acid or derivatives - Phenoxy compound - Styrene - Aryl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Morpholine - Oxazinane - Methyl ester - Carbamic acid ester - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Carboxylic acid ester - Ketone - Ether - Organoheterocyclic compound - Dialkyl ether - Azacycle - Carboxylic acid derivative - Oxacycle - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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