Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC(OCC2=CC(=O)OC3=C2C=C(OC)C=C3)=CC=C1)C(=O)OCC
InChIKey
InChIKey=IXZLFLRCPLURAJ-UHFFFAOYSA-N
Formula
C30H31NO8
Mass
533.577
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Dihydropyridinecarboxylic acids and derivatives Phenoxy compounds Anisoles Pyranones and derivatives Alkyl aryl ethers Dicarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Enoate esters Lactones Oxacyclic compounds Enamines Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Dihydropyridinecarboxylic acid derivative - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Dihydropyridine - Pyranone - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyridine - Benzenoid - Pyran - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Ether - Enamine - Organoheterocyclic compound - Azacycle - Oxacycle - Secondary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available