Compound Identification
SMILES
CC1=CN([C@H]2C[C@H](SC(=O)C3=CC=CC=C3)[C@@H](COP(O)(O)=O)O2)C(=O)NC1=O
InChIKey
InChIKey=DFPGVJYUAFRWFS-HZSPNIEDSA-N
Formula
C17H19N2O8PS
Mass
442.38
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
2',3'-dideoxy-3'-thionucleoside monophosphates
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
2',3'-dideoxy-3'-thionucleoside monophosphates
Alternative Parents
2',3'-dideoxy-3'-thionucleosides Thiobenzoic acids and derivatives Benzoic acids and derivatives Benzoyl derivatives Pyrimidones Monoalkyl phosphates Hydropyrimidines Vinylogous amides Oxolanes Heteroaromatic compounds Ureas Thioesters Carbothioic S-esters Lactams Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Carboxylic acids and derivatives Organonitrogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2',3'-dideoxy-3'-thionucleoside monophosphate - 2',3'-dideoxy-3'-thionucleoside - Benzoic acid or derivatives - Thiobenzoic acid or derivatives - Benzoyl - Pyrimidone - Monoalkyl phosphate - Monocyclic benzene moiety - Pyrimidine - Hydropyrimidine - Phosphoric acid ester - Alkyl phosphate - Benzenoid - Organic phosphoric acid derivative - Heteroaromatic compound - Vinylogous amide - Oxolane - Urea - Carbothioic s-ester - Thiocarboxylic acid ester - Lactam - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2',3'-dideoxy-3'-thionucleoside monophosphates. These are 2',3'-deoxyribonucleoside derivatives, where the ribose unit is thio-substituted at the 3'-position, and at the 5'-position by a monophosphate group. The nucleobases here are limited to purine, pyrimidine, and pyridine derivatives.
External Descriptors
Not available