Compound Identification
SMILES
COC1=CC=C2N=C(OC3=CC=C(C)C=C3)C(=CC2=C1)C1C(C#N)=C(N)OC2=C1C(=O)OC1=CC=CC=C21
InChIKey
InChIKey=DQZXWVHXZXFIDR-UHFFFAOYSA-N
Formula
C30H21N3O5
Mass
503.514
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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 Anisoles Toluenes Pyranones and derivatives Alkyl aryl ethers Pyridines and derivatives Vinylogous esters Heteroaromatic compounds Lactones Ketene acetals Oxacyclic compounds Azacyclic compounds Nitriles Amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular pyranocoumarin - Quinolone - Diaryl ether - Quinoline - 1-benzopyran - Benzopyran - Phenol ether - Phenoxy compound - Anisole - Pyranone - Toluene - Alkyl aryl ether - Pyran - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous ester - Ketene acetal or derivatives - Lactone - Oxacycle - Nitrile - Carbonitrile - Ether - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - 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