Compound Identification
SMILES
N[C@@H](CS)C(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N
InChIKey
InChIKey=CHQCHJWWSCSGOJ-MACXSXHHSA-N
Formula
C13H19N6O8PS
Mass
450.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Nucleosides, nucleotides, and analogues
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Class
Purine nucleotides
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Subclass
Purine ribonucleotides
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Level 5
Purine ribonucleoside monophosphates
- Level 6 5'-acylphosphoadenosines
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Level 5
Purine ribonucleoside monophosphates
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Subclass
Purine ribonucleotides
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Class
Purine nucleotides
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Superclass
Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Purine nucleotides
Subclass
Purine ribonucleotides
Intermediate Tree Nodes
Purine ribonucleoside monophosphates
Direct Parent
5'-acylphosphoadenosines
Alternative Parents
Pentose phosphates Cysteine and derivatives Glycosylamines 6-aminopurines Monosaccharide phosphates Phosphoethanolamines Acyl phosphates Aminopyrimidines and derivatives Monoalkyl phosphates N-substituted imidazoles Imidolactams Heteroaromatic compounds Oxolanes Secondary alcohols 1,2-diols Azacyclic compounds Oxacyclic compounds Alkylthiols Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5'-acylphosphoadenosine - Pentose phosphate - Pentose-5-phosphate - Cysteine or derivatives - N-glycosyl compound - Glycosyl compound - Monosaccharide phosphate - 6-aminopurine - Alpha-amino acid or derivatives - Pentose monosaccharide - Purine - Imidazopyrimidine - Phosphoethanolamine - Acyl phosphate - Aminopyrimidine - Monoalkyl phosphate - Imidolactam - Organic phosphoric acid derivative - Phosphoric acid ester - Monosaccharide - N-substituted imidazole - Pyrimidine - Alkyl phosphate - Heteroaromatic compound - Azole - Imidazole - Oxolane - Secondary alcohol - Amino acid or derivatives - 1,2-diol - Alkylthiol - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Alcohol - Organic oxide - Organic oxygen compound - Amine - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 5'-acylphosphoadenosines. These are ribonucleoside derivatives containing an adenoside moiety, where the phosphate group is acylated.
External Descriptors
Not available