Compound Identification
SMILES
O=C(C=CC1=CC=CC=C1)C1=C2C=CC=C3C4=NC5=CC=CC=C5N4C(=O)C(C=C1)=C23
InChIKey
InChIKey=FGZYZQQJESODNA-UHFFFAOYSA-N
Formula
C27H16N2O2
Mass
400.437
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 Isoquinolones and derivatives Naphthalenes Imidazo[1,2-a]pyridines Benzimidazoles Styrenes Aryl ketones Pyridinones N-substituted imidazoles Acryloyl compounds Heteroaromatic compounds Enones Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Isoquinolone - Isoquinoline - Naphthalene - Benzimidazole - Imidazo[1,2-a]pyridine - Aryl ketone - Styrene - Pyridinone - Monocyclic benzene moiety - N-substituted imidazole - Pyridine - Benzenoid - Acryloyl-group - Azole - Enone - Imidazole - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Ketone - Lactam - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - 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