Compound Identification
SMILES
CCOP(=O)(COC1CC(CC1O)N1C=C(C)C(=O)N(C(=O)C2=CC=CC=C2)C1=O)OCC
InChIKey
InChIKey=WITRGXPIVLOOSZ-UHFFFAOYSA-N
Formula
C22H29N2O8P
Mass
480.454
Taxonomic Classification
Taxonomy Tree
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Nucleoside and nucleotide analogues
Subclass
Phosphonated cyclopentyl nucleosides
Intermediate Tree Nodes
1,3-substituted phosphonated cyclopentyl nucleosides
Direct Parent
1,3-substituted phosphonated cyclopentyl pyrimidine nucleosides
Alternative Parents
Cyclopentyl nucleosides Benzoic acids and derivatives Benzoyl derivatives Pyrimidones Dialkyl alkylphosphonates Cyclopentanols Phosphonic acid esters Hydropyrimidines Heteroaromatic compounds Vinylogous amides Lactams Ureas Cyclic alcohols and derivatives Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organonitrogen compounds Organophosphorus compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,3-substituted phosphonated cyclopentyl pyrimidine nucleoside - Cyclopentyl nucleoside - Benzoic acid or derivatives - Benzoyl - Dialkyl alkylphosphonate - Pyrimidone - Phosphonic acid diester - Monocyclic benzene moiety - Cyclopentanol - Pyrimidine - Hydropyrimidine - Phosphonic acid ester - Benzenoid - Vinylogous amide - Organophosphonic acid derivative - Heteroaromatic compound - Cyclic alcohol - Lactam - Urea - Secondary alcohol - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organophosphorus compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-substituted phosphonated cyclopentyl pyrimidine nucleosides. These are nucleoside analogues with a structure that consists of a cyclobutane that is substituted a the 1-position with a phosphonate group, and at the 3-position with either a pyrimidine base.
External Descriptors
Not available