Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1N=CN2COCCOP(O)(=O)O[C@@H]1[C@H](O)[C@@H](COP(O)(=O)O[C@@H]2[C@H](O)[C@@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@@H](CO)O[C@H]3N3C=NC4=C3N=CN=C4NCC3=CC=CC=C3)O[C@H]2N2C=NC3=C2N=CN=C3N)O[C@H]1N1C=NC2=C1N=CN=C2N

InChIKey

InChIKey=VYYNHGKGEPEGDB-PGVFQOOMSA-N

Formula

C45H53N20O20P3

Mass

1286.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Purine nucleotides

Subclass

Purine ribonucleotides

Intermediate Tree Nodes

Purine ribonucleoside bisphosphates

Direct Parent

Purine ribonucleoside 2',5'-bisphosphates

Alternative Parents

Pentose phosphates 6-alkylaminopurines Glycosylamines Monosaccharide phosphates Benzylamines Secondary alkylarylamines Aminopyrimidines and derivatives Dialkyl phosphates Imidolactams N-substituted imidazoles Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Primary alcohols Primary amines Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purine ribonucleoside 2',5'-bisphosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-alkylaminopurine - 6-aminopurine - Monosaccharide phosphate - Imidazopyrimidine - Purine - Benzylamine - Aminopyrimidine - Dialkyl phosphate - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Benzenoid - Pyrimidine - Alkyl phosphate - Tetrahydrofuran - Azole - Imidazole - Heteroaromatic compound - Secondary alcohol - Organoheterocyclic compound - Azacycle - Secondary amine - Oxacycle - Organooxygen compound - Alcohol - Amine - Hydrocarbon derivative - Primary alcohol - Primary amine - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purine ribonucleoside 2',5'-bisphosphates. These are purine ribobucleotides with one phosphate group attached to 2' and 5' hydroxyl groups of the ribose moiety.

External Descriptors

Not available

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