Compound Identification
SMILES
NC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]1O[C@H](COP([O-])(=O)OC(=O)CCCC[C@@H]2CCSS2)[C@@H](O)[C@H]1O
InChIKey
InChIKey=CBFBRENOWPXOON-GDHWZLSQSA-M
Formula
C18H25N5O9PS2
Mass
550.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
-
Class
Purine nucleotides
- Subclass Purine ribonucleotides
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Class
Purine nucleotides
-
Superclass
Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Purine nucleotides
Subclass
Purine ribonucleotides
Intermediate Tree Nodes
Not available
Direct Parent
Purine ribonucleoside monophosphates
Alternative Parents
Pentose phosphates Lipoic acids and derivatives Glycosylamines Hypoxanthines Monosaccharide phosphates 6-oxopurines Pyrimidones Aminopyrimidines and derivatives Acyl phosphates N-substituted imidazoles Alkyl phosphates Vinylogous amides 1,2-dithiolanes Tetrahydrofurans Heteroaromatic compounds Amino acids and derivatives 1,2-diols Secondary alcohols Carboxylic acid salts Organic disulfides Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Primary amines Organic oxides Organic salts Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Lipoic_acid_derivative - Glycosyl compound - N-glycosyl compound - 6-oxopurine - Hypoxanthine - Monosaccharide phosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Acyl phosphate - Aminopyrimidine - Pyrimidone - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Alkyl phosphate - Pyrimidine - Dithiolane - Tetrahydrofuran - Heteroaromatic compound - Vinylogous amide - 1,2-dithiolane - Azole - Imidazole - Secondary alcohol - Amino acid or derivatives - 1,2-diol - Carboxylic acid salt - Organic disulfide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Azacycle - Alcohol - Organic salt - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organopnictogen compound - Primary amine - Amine - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purine ribonucleoside monophosphates. These are nucleotides consisting of a purine base linked to a ribose to which one monophosphate group is attached.
External Descriptors
CHEBI:86460 : organophosphate oxoanion