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]3COP(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)(NCC3=C4C=CC5=CC=CC6=C5C4=C(C=C3)C=C6)OCCCC3=CN(CCCO[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)N=N3)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=CN=C4N)N3C=C(C)C(=O)NC3=O)N3C=CC(N)=NC3=O)N3C=NC4=C3N=C(N)NC4=O)O2)C(=O)NC1=O

InChIKey

InChIKey=CQSBGBSVWZHULP-VXYIMELISA-N

Formula

C90H110N26O43P6

Mass

2429.852

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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 bisphosphate - Pyrimidine deoxyribonucleoside 3',5'-bisphosphate - Pyrimidine 2'-deoxyribonucleoside monophosphate - Ribonucleoside 3'-phosphate - Pyrene - Pentose phosphate - Phenanthrene - Glycosyl compound - O-glycosyl compound - 6-aminopurine - 6-oxopurine - Hypoxanthine - Naphthalene - Monosaccharide phosphate - Purine - Imidazopyrimidine - Phosphoric diester monoamide - Aminopyrimidine - Dialkyl phosphate - Pyrimidone - Hydropyrimidine - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Oxane - Phosphoric acid ester - Primary aromatic amine - Imidolactam - Organic phosphoric acid amide - Benzenoid - Alkyl phosphate - Pyrimidine - Vinylogous amide - Imidazole - Oxolane - 1,2,3-triazole - Azole - Heteroaromatic compound - Urea - Lactam - Secondary alcohol - Acetal - Azacycle - Oxacycle - Organoheterocyclic compound - Polyol - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Primary alcohol - Primary amine - Organooxygen compound - Organopnictogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Organic oxide - 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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