Compound Identification
SMILES
NC1=NC(N)=C(C2=CC=CC=C2)C(OCCOCP(O)(O)=O)=N1
InChIKey
InChIKey=YSPCIIOMPKFJTQ-UHFFFAOYSA-N
Formula
C13H17N4O5P
Mass
340.276
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Nucleoside and nucleotide analogues
Subclass
Acyclic 2,4-diaminopyrimidine nucleoside phosphonates
Intermediate Tree Nodes
Not available
Direct Parent
Acyclic 2,4-diaminopyrimidine nucleoside phosphonates
Alternative Parents
Phenylpyrimidines Aminopyrimidines and derivatives Alkyl aryl ethers Imidolactams Benzene and substituted derivatives Organic phosphonic acids Heteroaromatic compounds Azacyclic compounds Primary amines Organophosphorus compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,4-diaminopyrimidine nucleoside phosphonate - 5-phenylpyrimidine - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Organophosphonic acid - Heteroaromatic compound - Organophosphonic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organophosphorus compound - Organic oxygen compound - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acyclic 2,4-diaminopyrimidine nucleoside phosphonates. These are pyrimidine nucleoside analogues with a structure that is characterized by a phosphonylmethoxyethoxyl group that is linked to the N1 atom of a 2,4-diaminopyrimidine.
External Descriptors
Not available