Compound Identification
SMILES
CCOC(=O)CCC1=CC(=O)OC2=C3[C@@H]4CC(=O)O[C@@H]4OC3=CC(OC)=C12
InChIKey
InChIKey=QVWXRPOJXZSDGL-OVWNDWIMSA-N
Formula
C19H18O8
Mass
374.345
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
- Subclass Difurocoumarins
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Difurocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Difurocoumarins
Alternative Parents
Angular furanocoumarins 1-benzopyrans Coumarans Anisoles Pyranones and derivatives Alkyl aryl ethers Fatty acid esters Dicarboxylic acids and derivatives Gamma butyrolactones Heteroaromatic compounds Oxolanes Carboxylic acid esters Oxacyclic compounds Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Difurocoumarin - Angular furanocoumarin - Furanocoumarin - 1-benzopyran - Benzopyran - Coumaran - Anisole - Fatty acid ester - Alkyl aryl ether - Pyranone - Fatty acyl - Benzenoid - Pyran - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxolane - Heteroaromatic compound - Carboxylic acid ester - Lactone - Acetal - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as difurocoumarins. These are polycyclic aromatic compounds containing difurocoumarin moiety consisting of a system of two fused furan rings, which is linked to the benzene ring of a coumarin.
External Descriptors
Not available