Compound Identification
SMILES
NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](CO[P+](=O)O[C@H](CC2=CC=CC=C2)C(O)=O)[C@@H](O)[C@H]1O
InChIKey
InChIKey=NZWMATGIQFVOBJ-CCECPURYSA-O
Formula
C18H21N3O9P
Mass
454.351
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Deoxyribo- and ribonucleoside phosphonates
Subclass
Purine ribonucleoside phosphonates
Intermediate Tree Nodes
Not available
Direct Parent
Purine ribonucleoside phosphonates
Alternative Parents
Pyrimidine nucleosides Phenylpropanoic acids Glycosylamines Pentoses Aminopyrimidines and derivatives Pyrimidones Benzene and substituted derivatives Hydropyrimidines Imidolactams Oxolanes Heteroaromatic compounds Amino acids 1,2-diols Secondary alcohols Oxacyclic compounds Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary amines Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Purine ribonucleoside phosphonate - Pyrimidine nucleoside - 3-phenylpropanoic-acid - N-glycosyl compound - Glycosyl compound - Pentose monosaccharide - Aminopyrimidine - Pyrimidone - Pyrimidine - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Imidolactam - Hydropyrimidine - Oxolane - Heteroaromatic compound - Secondary alcohol - Amino acid - 1,2-diol - Amino acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as purine ribonucleoside phosphonates. These are n-glycosyl compound that possess both a purine nucleobase linked to either a ribose or deoxyribose, which in turn carries a phosphonate group at the 5'-position.
External Descriptors
Not available