Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Difurocoumarins

Intermediate Tree Nodes

Not available

Direct Parent

Difurocoumarins

Alternative Parents

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

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