Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC1C(O)C(CO)OC1N1C(Br)=C(C(N)=O)C2=C1N=CN=C2N

InChIKey

InChIKey=JBJUJAKJNYCMMS-UHFFFAOYSA-N

Formula

C19H20BrN5O7S

Mass

542.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Pyrrolopyrimidine nucleosides and nucleotides

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolopyrimidine nucleosides and nucleotides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolopyrimidine ribonucleoside - P-methylbenzenesulfonate - Benzenesulfonate ester - N-glycosyl compound - Glycosyl compound - Pentose monosaccharide - Benzenesulfonate - Tosyl compound - Pyrrolopyrimidine - Pyrrolo[2,3-d]pyrimidine - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Aminopyrimidine - Toluene - Imidolactam - Benzenoid - Organosulfonic acid ester - Aryl halide - Aryl bromide - Monosaccharide - Substituted pyrrole - Monocyclic benzene moiety - Pyrimidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tetrahydrofuran - Pyrrole - Vinylogous halide - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Secondary alcohol - Primary carboxylic acid amide - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alcohol - Primary alcohol - Primary amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolopyrimidine nucleosides and nucleotides. These are nucleoside derivatives containing a ribose derivative which is n-glycosylated to a pyrrolopyrimidine. Also called deazapurine nucleosides, they are analogs of purine nucleosides with the N atom of the purine being replaced by a C atom at position 7.

External Descriptors

Not available

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