Compound Identification
SMILES
COC1=C(OCC2=CC=CC=C2)C=CC(C=C(C(=O)C2=CC=CC=C2)C2=NC3=CC=CC=C3O2)=C1
InChIKey
InChIKey=JQQRERXHXUBJIJ-UHFFFAOYSA-N
Formula
C30H23NO4
Mass
461.517
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 Benzoxazoles Phenoxy compounds Anisoles Aryl ketones Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Alpha-branched alpha,beta-unsaturated ketones Acryloyl compounds Oxazoles Heteroaromatic compounds Enones Azacyclic compounds Oxacyclic compounds Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Benzoxazole - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Aryl ketone - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Azole - Enone - Oxazole - Acryloyl-group - Ketone - Ether - Organoheterocyclic compound - Oxacycle - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Aldehyde - Organic nitrogen compound - Organopnictogen compound - Organooxygen compound - Organic oxygen 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