Compound Identification
SMILES
NC1=NC=NC2=C1N=CN2[C@@H]1OC(COP(O)(=O)OC(=O)C2CO\C(N2)=C2/NC3=CC(=O)C=CC3=N2)[C@@H](O)[C@H]1O
InChIKey
InChIKey=CIHJFYWGKNZEJF-VWYAOUQTSA-N
Formula
C21H21N8O10P
Mass
576.419
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 Glycosylamines Alpha amino acids and derivatives Monosaccharide phosphates 6-aminopurines Aminopyrimidines and derivatives Monoalkyl phosphates Acyl phosphates Imidolactams N-substituted imidazoles Oxolanes Heteroaromatic compounds Oxazolidines Vinylogous amides 1,2-diols Cyclic ketones Secondary alcohols Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Primary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5'-acylphosphoadenosine - Pentose-5-phosphate - Pentose phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Alpha-amino acid or derivatives - Monosaccharide phosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Acyl phosphate - Aminopyrimidine - Monoalkyl phosphate - Organic phosphoric acid derivative - Pyrimidine - Alkyl phosphate - N-substituted imidazole - Phosphoric acid ester - Imidolactam - Monosaccharide - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Oxazolidine - Oxolane - Cyclic ketone - Secondary alcohol - Amino acid or derivatives - 1,2-diol - Ketone - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Carbonyl group - Amine - Hydrocarbon derivative - Primary amine - Alcohol - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - 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