Compound Identification
SMILES
CCCCCCCCCCCCS(=O)CC(COP(O)(=O)OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)N1C=NC2=C1N=C(Cl)N=C2OC)OCCCCCCCCCC
InChIKey
InChIKey=BZDJITOPZIBVDX-WKUJHCSRSA-N
Formula
C36H63ClFN4O9PS
Mass
813.4
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
Hypoxanthines 2-halopyrimidines Alkyl aryl ethers Dialkyl phosphates Aryl chlorides N-substituted imidazoles Oxolanes Heteroaromatic compounds Sulfoxides Secondary alcohols Fluorohydrins Sulfinyl compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organonitrogen compounds Alkyl fluorides Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purine 2'-deoxyribonucleoside monophosphate - Hypoxanthine - Imidazopyrimidine - Purine - Alkyl aryl ether - 2-halopyrimidine - Dialkyl phosphate - Halopyrimidine - Organic phosphoric acid derivative - N-substituted imidazole - Aryl chloride - Phosphoric acid ester - Aryl halide - Pyrimidine - Alkyl phosphate - Azole - Imidazole - Heteroaromatic compound - Oxolane - Secondary alcohol - Sulfoxide - Fluorohydrin - Halohydrin - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organofluoride - Organochloride - 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