Structure Information
Structure

Compound Identification

SMILES

COC1C(OC2COP(O)(=O)OC12)N1C=NC2=C1N=C(SC1=CC=CC=C1)N=C2N

InChIKey

InChIKey=BTPQOHIENWQQNT-UHFFFAOYSA-N

Formula

C17H18N5O6PS

Mass

451.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Purine nucleotides

Subclass

Cyclic purine nucleotides

Intermediate Tree Nodes

Not available

Direct Parent

3',5'-cyclic purine nucleotides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3',5'-cyclic purine ribonucleotide - Pentose phosphate - Glycosyl compound - N-glycosyl compound - Diarylthioether - 6-aminopurine - Monosaccharide phosphate - Imidazopyrimidine - Purine - Aryl thioether - Thiophenol ether - Aminopyrimidine - Monocyclic benzene moiety - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Imidolactam - Pyrimidine - Benzenoid - Oxolane - Azole - Imidazole - Heteroaromatic compound - Sulfenyl compound - Thioether - Organoheterocyclic compound - Dialkyl ether - Ether - Azacycle - Oxacycle - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic oxide - Primary amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3',5'-cyclic purine nucleotides. These are purine nucleotides in which the oxygen atoms linked to the C3 and C5 carbon atoms of the ribose moiety are both bonded the same phosphorus atom of the phosphate group.

External Descriptors

Not available

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