Compound Identification
SMILES
O=C1COC2=C1C1=C(C(=O)CO1)C1=C2C=CC(=O)O1
InChIKey
InChIKey=MINGKNMYQIBXNH-UHFFFAOYSA-N
Formula
C13H6O6
Mass
258.185
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 Benzofurans Aryl alkyl ketones Pyranones and derivatives Alkyl aryl ethers Benzenoids Heteroaromatic compounds Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Difurocoumarin - Angular furanocoumarin - Furanocoumarin - Benzopyran - 1-benzopyran - Coumaran - Benzofuran - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Lactone - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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