Structure Information
Structure

Compound Identification

SMILES

CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC[NH+](CC)CC.CC1=CN([C@H]2C[C@H](OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H]3O[C@H](C[C@@H]3OP([O-])(=O)OC[C@H](O)CN3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=CN=C4N)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)N3C=NC4=C3N=C(N)NC4=O)[C@@H](COCC3=CC(OCC4=CC=CC=C4)=C(OCC4=CC=CC=C4)C=C3)O2)C(=O)NC1=O

InChIKey

InChIKey=ODMFMKPTIKTFTN-BIFLLIEOSA-N

Formula

C125H192N38O41P6

Mass

3068.979

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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

Not available

Substituents

Purine deoxyribonucleoside 3',5'-bisphosphate - Ribonucleoside 3'-phosphate - 6-aminopurine - 6-oxopurine - Hypoxanthine - Benzylether - Imidazopyrimidine - Purine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - Dialkyl phosphate - Monocyclic benzene moiety - Hydropyrimidine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Pyrimidine - Benzenoid - Alkyl phosphate - Vinylogous amide - Oxolane - Quaternary ammonium salt - Azole - Heteroaromatic compound - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Lactam - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxygen compound - Primary amine - Alcohol - 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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