Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]4O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]4O)C=C3)=N2)N1

InChIKey

InChIKey=OFCCAICXJLPDDB-YIRCSUOXSA-L

Formula

C23H31N6O12P

Mass

614.506

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Monosaccharides - Pentoses

Direct Parent

Pentose phosphates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pentose phosphate - Pentose-5-phosphate - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Alkyl glycoside - Pterin - Glycosyl compound - O-glycosyl compound - Pteridine - Monosaccharide phosphate - Phenylalkylamine - Aniline or substituted anilines - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Alkyl phosphate - Benzenoid - Phosphoric acid ester - Organic phosphoric acid derivative - Pyrimidine - Fatty acyl - Monocyclic benzene moiety - Primary aromatic amine - Heteroaromatic compound - Vinylogous amide - Oxolane - Secondary alcohol - Ketimine - Polyol - Secondary amine - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Imine - Amine - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organonitrogen compound - Organic nitrogen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups.

External Descriptors

Not available

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