Compound Identification
SMILES
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]3O)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=KNBGBQOXRBUIGJ-UTKQWVMNSA-N
Formula
C81H92N27O36P5
Mass
2174.649
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
- Class Purine nucleotides
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Superclass
Nucleosides, nucleotides, and analogues
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
Purine 2'-deoxyribonucleoside monophosphates Ribonucleoside 3'-phosphates Hypoxanthines 6-aminopurines 6-oxopurines Benzylethers Phenol ethers Phenoxy compounds Dialkyl phosphates Pyrimidones Aminopyrimidines and derivatives Alkyl aryl ethers N-substituted imidazoles Hydropyrimidines Imidolactams Heteroaromatic compounds Vinylogous amides Oxolanes Ureas Secondary alcohols Lactams Azacyclic compounds Oxacyclic compounds Dialkyl ethers Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purine deoxyribonucleoside 3',5'-bisphosphate - Purine 2'-deoxyribonucleoside monophosphate - Ribonucleoside 3'-phosphate - 6-aminopurine - 6-oxopurine - Hypoxanthine - Benzylether - Imidazopyrimidine - Purine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Dialkyl phosphate - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Benzenoid - Pyrimidine - Alkyl phosphate - Oxolane - Azole - Vinylogous amide - Heteroaromatic compound - Imidazole - Urea - Secondary alcohol - Lactam - Organoheterocyclic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Alcohol - Amine - Primary amine - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organonitrogen 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