Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1N=C(SCC(=O)C(=O)CBr)[C@@H]2C1O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O

InChIKey

InChIKey=MBHGQJDMVLQMHO-QDLLXIDESA-N

Formula

C15H19BrN4O12P2S

Mass

621.24

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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-5-phosphate - Pentose phosphate - Organic pyrophosphate - Pyrrolopyrimidine - Imidolactam - Imidothiolactone - Alkyl phosphate - Pyrimidine - Phosphoric acid ester - Organic phosphoric acid derivative - Alpha-diketone - Alpha-haloketone - Heteroaromatic compound - Tetrahydrofuran - Pyrrole - Secondary alcohol - Ketone - Imidothioester - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Imidothioic acid or derivatives - Ether - Dialkyl ether - Amidine - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Alkyl halide - Alkyl bromide - Alcohol - 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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