Compound Identification
SMILES
CC1=CC=C(OC2=C(C=C3C=C(C)C=CC3=N2)C2C(C#N)=C(N)OC3=C2C(=O)OC2=CC=CC=C32)C=C1
InChIKey
InChIKey=TWYHYNZCBPSNSA-UHFFFAOYSA-N
Formula
C30H21N3O4
Mass
487.515
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Pyranocoumarins
- Level 5 Angular pyranocoumarins
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Subclass
Pyranocoumarins
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Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Pyranocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Angular pyranocoumarins
Alternative Parents
Quinolones and derivatives Diarylethers 1-benzopyrans Phenoxy compounds Phenol ethers Toluenes Pyranones and derivatives Pyridines and derivatives Vinylogous esters Heteroaromatic compounds Lactones Ketene acetals Oxacyclic compounds Azacyclic compounds Nitriles Hydrocarbon derivatives Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular pyranocoumarin - Diaryl ether - Quinolone - Quinoline - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - Toluene - Pyranone - Benzenoid - Pyridine - Pyran - Monocyclic benzene moiety - Vinylogous ester - Heteroaromatic compound - Lactone - Ketene acetal or derivatives - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as angular pyranocoumarins. These are organic compounds containing a pyran (or a hydrogenated derivative) angularly fused to a coumarin moiety.
External Descriptors
Not available