Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3COC(=O)NC3=CN=C(O3)C3=CC4=CC5=C(OCO5)C=C4O3)N3C=NC4=C3N=CN=C4N)N3C=NC4=C3NC(N)=NC4=O)N3C=CC(N)=NC3=O)O2)C(=O)NC1=O

InChIKey

InChIKey=RQTSLSSHTBUOEA-QMPJJLPESA-N

Formula

C52H56N17O27P3

Mass

1444.033

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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

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 - Benzodioxole - Benzofuran - Imidazopyrimidine - Purine - 2,5-disubstituted 1,3-oxazole - Aminopyrimidine - Dialkyl phosphate - Pyrimidone - Hydropyrimidine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Primary aromatic amine - Imidolactam - Benzenoid - Alkyl phosphate - Pyrimidine - Oxolane - Oxazole - Carbamic acid ester - Azole - Vinylogous amide - Imidazole - Heteroaromatic compound - Furan - Urea - Secondary alcohol - Lactam - Acetal - Organoheterocyclic compound - Azacycle - Oxacycle - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary amine - 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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