Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)C(=O)NC1=O.COC1=CC2=C(NC(=S)[C@H](CSC)N2C(=O)OC(C)C)C=C1.CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(N)=O)NC(=O)C1=NC2=CC=CC=C2C=C1

InChIKey

InChIKey=JWGBROSZONFVGR-KKDZIWDSSA-N

Formula

C63H83N13O12S2

Mass

1278.56

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Pyrimidine nucleosides

Subclass

Pyrimidine 2',3'-dideoxyribonucleosides

Intermediate Tree Nodes

Not available

Direct Parent

Pyrimidine 2',3'-dideoxyribonucleosides

Alternative Parents

Molecular Framework

Not available

Substituents

Pyrimidine 2',3'-dideoxyribonucleoside - Asparagine or derivatives - N-acyl-alpha amino acid or derivatives - Quinoline-2-carboxamide - Alpha-amino acid amide - Phenylbutylamine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Quinoline - Amphetamine or derivatives - 2-piperidinecarboxamide - Piperidinecarboxamide - Pyridine carboxylic acid or derivatives - Anisole - Phenol ether - 2-heteroaryl carboxamide - Aralkylamine - Alkyl aryl ether - Pyrimidone - Benzenoid - Fatty acyl - Monocyclic benzene moiety - N-acyl-amine - Piperidine - Hydropyrimidine - Fatty amide - Pyridine - Pyrimidine - Vinylogous amide - Oxolane - Carbamic acid ester - Thiolactam - Heteroaromatic compound - Lactam - Primary carboxylic acid amide - Carboxamide group - Azo imide - Tertiary aliphatic amine - Urea - 1,2-aminoalcohol - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Azo compound - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Carbonyl group - Hydrocarbon derivative - Organic zwitterion - Organic oxide - Organic salt - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Thiocarbonyl group - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidine 2',3'-dideoxyribonucleosides. These are compounds consisting of a pyrimidine linked to a ribose which lacks a hydroxyl group at positions 2 and 3.

External Descriptors

Not available

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