Compound Identification
SMILES
COC1=CC=C(C=C1)C1C2=C(OC(N=CN3CCOCC3)=C1C#N)C=C(O)C=C2
InChIKey
InChIKey=RCXOXJWQVHLLEE-UHFFFAOYSA-N
Formula
C22H21N3O4
Mass
391.427
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Neoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Neoflavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Neoflavonoids
Alternative Parents
1-benzopyrans Phenoxy compounds Methoxybenzenes Anisoles 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Morpholines Ketene acetals Propargyl-type 1,3-dipolar organic compounds Formamidines Dialkyl ethers Carboximidamides Carboxamidines Azacyclic compounds Nitriles Oxacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Neoflavonoid skeleton - Benzopyran - 1-benzopyran - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Ketene acetal or derivatives - Oxacycle - Azacycle - Carboxylic acid amidine - Dialkyl ether - Ether - Organoheterocyclic compound - Amidine - Carboximidamide - Formamidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Nitrile - Carbonitrile - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as neoflavonoids. These are compounds with a structure based on the 4-phenylchromene backbone.
External Descriptors
Not available