Structure Information
Structure

Compound Identification

SMILES

COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C2C3C(O)C(OC3OC2=C1)N(C=O)C1=C(NC2CC(O)C(CO[P+](O)=O)O2)NC(N)=NC1=O

InChIKey

InChIKey=WDNYTWXQMRQADC-UHFFFAOYSA-P

Formula

C27H27N5O14P

Mass

676.507

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Furanocoumarins

Intermediate Tree Nodes

Angular furanocoumarins - Aflatoxins

Direct Parent

Difurocoumarocyclopentenones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Difurocoumarocyclopentenone - Difurocoumarin - Pentose monosaccharide - Benzopyran - 1-benzopyran - Coumaran - Anisole - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Aminopyrimidine - Pyranone - Pyrimidone - Secondary aliphatic/aromatic amine - Monosaccharide - Primary aromatic amine - Pyran - Pyrimidine - Benzenoid - Hydropyrimidine - Oxolane - Heteroaromatic compound - Vinylogous amide - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary alcohol - Ketone - Lactone - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Aldehyde - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as difurocoumarocyclopentenones. These are polycyclic aromatic compounds containing a cyclopenten-2-one ring fused to the coumarin moiety of the difurocoumarin skeleton.

External Descriptors

Not available

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