Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)O[C@H]3C[C@@H](O[C@@H]3C(=O)NCCCCCCN[C@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)N3C=C(C)C(=O)NC3=O)O2)C(=O)NC1=O

InChIKey

InChIKey=PTMQZNDUSHLJKO-OCDCFIDLSA-N

Formula

C38H63N10O17P

Mass

962.949

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Pyrimidine nucleotides

Subclass

Pyrimidine deoxyribonucleotides

Intermediate Tree Nodes

Pyrimidine deoxyribonucleoside monophosphates

Direct Parent

Pyrimidine 2'-deoxyribonucleoside monophosphates

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aminoglycoside core - Pyrimidine 2'-deoxyribonucleoside monophosphate - Ribonucleoside 3'-phosphate - Pentose phosphate - Glycosyl compound - O-glycosyl compound - Monosaccharide phosphate - Cyclohexanol - Cyclohexylamine - Pyrimidone - Amino saccharide - Dialkyl phosphate - Alkyl phosphate - Hydropyrimidine - Monosaccharide - Organic phosphoric acid derivative - Oxane - Phosphoric acid ester - Pyrimidine - Vinylogous amide - Cyclic alcohol - Tetrahydrofuran - Heteroaromatic compound - Secondary alcohol - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - 1,2-aminoalcohol - Lactam - Urea - Secondary amine - Oxacycle - Carboxylic acid derivative - Azacycle - Acetal - Secondary aliphatic amine - Organoheterocyclic compound - Hydrocarbon derivative - Organonitrogen compound - Primary amine - Alcohol - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Amine - Primary aliphatic amine - Organopnictogen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidine 2'-deoxyribonucleoside monophosphates. These are pyrimidine nucleotides with a monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2.

External Descriptors

Not available

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