Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC(=O)C1=CC=CO1)C1C(C#N)=C(N)OC2=C1C(=O)OC1=CC=CC=C21
InChIKey
InChIKey=CDHJLSPCJPYUOO-UHFFFAOYSA-N
Formula
C26H18N2O8
Mass
486.436
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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
Phenol esters 1-benzopyrans Dimethoxybenzenes Furoic acid esters Phenoxy compounds Anisoles Pyranones and derivatives Alkyl aryl ethers Vinylogous esters Heteroaromatic compounds Carboxylic acid esters Lactones Ketene acetals Monocarboxylic acids and derivatives Nitriles Oxacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular pyranocoumarin - 1-benzopyran - Benzopyran - Dimethoxybenzene - Phenol ester - M-dimethoxybenzene - Furoic acid ester - Furoic acid or derivatives - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Monocyclic benzene moiety - Vinylogous ester - Furan - Heteroaromatic compound - Carboxylic acid ester - Ketene acetal or derivatives - Lactone - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Cyanide - Organopnictogen compound - Hydrocarbon derivative - 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