Structure Information
Structure

Compound Identification

SMILES

CC[C@H]1O[C@@H](CN2C=NC3=C2N=C(C)N=C3OCCC2=CC=C(C=C2)[N+]([O-])=O)C[C@H]1C

InChIKey

InChIKey=IGUKQZJPVVIQCK-NIKGAXFTSA-N

Formula

C22H27N5O4

Mass

425.489

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Purinones

Direct Parent

Hypoxanthines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hypoxanthine - Nitrobenzene - Nitroaromatic compound - Alkyl aryl ether - Monocyclic benzene moiety - N-substituted imidazole - Pyrimidine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Oxolane - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Dialkyl ether - Ether - Azacycle - Organic oxoazanium - Oxacycle - Hydrocarbon derivative - Organic salt - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

External Descriptors

Not available

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