Compound Identification
SMILES
[Na+].CCCCCCCCCCCCCCCC(=O)OC[C@@H](COP([O-])(=O)OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)N1C=NC2=C1N=C(Cl)N=C2N)OC(=O)CCCCCCCCCCCCCCC
InChIKey
InChIKey=PKNUTKXSSFFFFO-USXVRVPXSA-M
Formula
C45H77ClFN5NaO10P
Mass
956.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
- Class Purine nucleotides
-
Superclass
Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Purine nucleotides
Subclass
Purine deoxyribonucleotides
Intermediate Tree Nodes
Purine deoxyribonucleoside monophosphates
Direct Parent
Purine 2'-deoxyribonucleoside monophosphates
Alternative Parents
6-aminopurines Glycerophospholipids Dialkyl phosphates 2-halopyrimidines Fatty acid esters Aminopyrimidines and derivatives Dicarboxylic acids and derivatives Aryl chlorides N-substituted imidazoles Imidolactams Oxolanes Heteroaromatic compounds Secondary alcohols Amino acids and derivatives Fluorohydrins Carboxylic acid esters Azacyclic compounds Organic metal halides Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic sodium salts Organic zwitterions Organochlorides Alkyl fluorides Organofluorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purine 2'-deoxyribonucleoside monophosphate - 6-aminopurine - Glycerophospholipid - Purine - Imidazopyrimidine - Aminopyrimidine - 2-halopyrimidine - Dialkyl phosphate - Fatty acid ester - Halopyrimidine - Phosphoric acid ester - Aryl chloride - Aryl halide - Pyrimidine - Fatty acyl - Dicarboxylic acid or derivatives - Imidolactam - N-substituted imidazole - Organic phosphoric acid derivative - Alkyl phosphate - Heteroaromatic compound - Oxolane - Azole - Imidazole - Amino acid or derivatives - Carboxylic acid ester - Fluorohydrin - Halohydrin - Secondary alcohol - Organic metal halide - Carboxylic acid derivative - Oxacycle - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Organochloride - Organofluoride - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Alcohol - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary amine - Organic oxygen compound - Organic sodium salt - Organic nitrogen compound - Organic salt - Organohalogen compound - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purine 2'-deoxyribonucleoside monophosphates. These are purine nucleotides with monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2.
External Descriptors
Not available