Structure Information
Structure

Compound Identification

SMILES

CCN1C=C(C(O)=NCC(O)=NC[C@H]2O[C@@H](C[C@H]2OP(O)(=O)OC[C@H]2O[C@@H]([C@@H](O)[C@H]2OP(O)(=O)OC[C@H]2O[C@@H]([C@@H](O)[C@H]2OP(O)(=O)OC[C@H]2O[C@@H](C(O)[C@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)C2OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)N2C=CC(=N)N=C2O)N2C=NC3=C2NC(=N)N=C3O)N2C=CC(=N)N=C2O)N2C=NC3=C2NC(=N)N=C3O)N2C=C(C)C(O)=NC2=O)C(=O)C2=CC3=C(OCO3)C=C12

InChIKey

InChIKey=LYMSQUZPDHPBBU-DZPGRGLGSA-N

Formula

C73H87N26O43P5

Mass

2171.507

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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 3',5'-bisphosphates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purine ribonucleoside 3',5'-bisphosphate - Purine ribonucleoside monophosphate - Pentose-5-phosphate - Pentose phosphate - Ribonucleoside 3'-phosphate - Glycosyl compound - N-glycosyl compound - Dihydroquinolone - Quinoline - Dihydroquinoline - 6-aminopurine - Monosaccharide phosphate - Imidazopyrimidine - Purine - Benzodioxole - Hydroxypyrimidine - Pyrimidone - Aminopyrimidine - Dialkyl phosphate - N-substituted imidazole - Organic phosphoric acid derivative - Monosaccharide - Hydropyrimidine - Phosphoric acid ester - Primary aromatic amine - Alkyl phosphate - Pyrimidine - Pyridine - Benzenoid - Imidolactam - Imidazole - Oxolane - Vinylogous amide - Heteroaromatic compound - Azole - Secondary alcohol - Acetal - Carboximidic acid - Carboximidic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purine ribonucleoside 3',5'-bisphosphates. These are purine ribobucleotides with one phosphate group attached to 3' and 5' hydroxyl groups of the ribose moiety.

External Descriptors

Not available

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