Structure Information
Structure

Compound Identification

SMILES

CC1=CN(C2CC(OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3OP(O)(=O)OCC3OC(CC3O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)N3C=CC(N)=NC3=O)N3C=C(C)C(=O)NC3=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)C(COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OC3CC(OC3COP(O)(=O)OCCCNC(=O)\C=C\C3=CNC=N3)N3C=NC4=C3N=CN=C4N)N3C=CC(N)=NC3=O)N3C=CC(N)=NC3=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)N3C=NC4=C3N=CN=C4N)N3C=CC(N)=NC3=O)N3C=NC4=C3N=CN=C4N)N3C=CC(N)=NC3=O)O2)C(=O)NC1=O

InChIKey

InChIKey=AKRRSRPZSUFVCD-SNAWJCMRSA-N

Formula

C171H219N66O101P17

Mass

5341.548

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Purine nucleotides

Subclass

Purine deoxyribonucleotides

Intermediate Tree Nodes

Purine deoxyribonucleoside bisphosphates

Direct Parent

Purine deoxyribonucleoside 3',5'-bisphosphates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Polysaccharide phosphate - Polysaccharide - Purine deoxyribonucleoside 3',5'-bisphosphate - Pyrimidine deoxyribonucleoside 3',5'-bisphosphate - Pyrimidine deoxyribonucleoside bisphosphate - Pyrimidine 2'-deoxyribonucleoside monophosphate - Ribonucleoside 3'-phosphate - 6-aminopurine - 6-oxopurine - Hypoxanthine - Imidazopyrimidine - Purine - Aminopyrimidine - Dialkyl phosphate - Pyrimidone - Hydropyrimidine - Alkyl phosphate - Pyrimidine - N-substituted imidazole - Imidolactam - Organic phosphoric acid derivative - Phosphoric acid ester - Imidazole - Vinylogous amide - Azole - Oxolane - Heteroaromatic compound - Carboxamide group - Amino acid or derivatives - Secondary alcohol - Urea - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Azacycle - Alcohol - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Primary amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purine deoxyribonucleoside 3',5'-bisphosphates. These are purine ribobucleotides with one phosphate group attached to each of two different hydroxyl groups of the ribose moiety, which lacks a hydroxyl group at position 2.

External Descriptors

Not available

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