Structure Information
Structure

Compound Identification

SMILES

CCCC(=O)O[C@H]1[C@@H](O[C@@](CO[P@@]2(=O)OCC[C@H](O2)C2=CC(Cl)=CC=C2)([N-][N+]#N)[C@H]1OC(=O)CCC)N1C=CC(=O)NC1=O

InChIKey

InChIKey=RKBAUBGPYSBUKS-CNCCTXFISA-N

Formula

C26H31ClN5O11P

Mass

655.98

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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 heteromonocyclic compounds

Substituents

Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - Monosaccharide phosphate - Chlorobenzene - Fatty acid ester - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyrimidine - Organic phosphoric acid derivative - Fatty acyl - Phosphoric acid ester - Pyrimidine - Benzenoid - Vinylogous amide - Oxolane - Heteroaromatic compound - Urea - Carboxylic acid ester - Azo compound - Azo imide - Lactam - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organochloride - Carbonyl group - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organohalogen compound - Aromatic heteromonocyclic 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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