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Structure Information
Structure

Compound Identification

SMILES

COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C2C3C(O)C(OC3OC2=C1)N1C=[N+](C2CC(O)C(COP(O)(O)=O)O2)C2=C1C(=O)N=C(N)N2

InChIKey

InChIKey=OBYKYKOLZOZQPE-UHFFFAOYSA-O

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 - Purine 2'-deoxyribonucleoside monophosphate - Difurocoumarin - 6-oxopurine - 1-benzopyran - Hypoxanthine - Benzopyran - Purine - Imidazopyrimidine - Coumaran - Aryl alkyl ketone - Aryl ketone - Anisole - Aminopyrimidine - Alkyl aryl ether - Pyranone - Pyrimidone - Monoalkyl phosphate - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Primary aromatic amine - Benzenoid - Pyran - Pyrimidine - Alkyl phosphate - Vinylogous amide - Oxolane - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - Ketone - Lactone - Oxacycle - Ether - Azacycle - Acetal - Organoheterocyclic compound - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Alcohol - Organic oxygen compound - Organic oxide - Organopnictogen compound - Amine - Organic nitrogen 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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