Compound Identification
SMILES
COC1=C2C3=C(C(CC3)=NC(CO)(CO)CO)C(=O)OC2=C2C3C(O)C(O)OC3OC2=C1
InChIKey
InChIKey=FDHBXCJFVVNQKW-UHFFFAOYSA-N
Formula
C21H23NO10
Mass
449.412
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
- Subclass Difurocoumarins
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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 Tetrahydrofurans Secondary ketimines Heteroaromatic compounds Azomethines Secondary alcohols Lactones Hemiacetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Acetals Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Difurocoumarin - Furanocoumarin - Angular furanocoumarin - 1-benzopyran - Benzopyran - Coumaran - Anisole - Pyranone - Alkyl aryl ether - Benzenoid - Pyran - Heteroaromatic compound - Tetrahydrofuran - Secondary ketimine - Azomethine - Secondary alcohol - Lactone - Ketimine - Hemiacetal - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Imine - Alcohol - 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