Structure Information
Structure

Compound Identification

SMILES

NC1=CC=C(CC2=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@@H]3F)C(=O)NC2=O)C=C1

InChIKey

InChIKey=PLIDZHRELITHSK-QVHKTLOISA-N

Formula

C16H20FN3O11P2

Mass

511.292

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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 bisphosphates

Direct Parent

Pyrimidine deoxyribonucleoside 3',5'-bisphosphates

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Pyrimidine deoxyribonucleoside 3',5'-bisphosphate - Ribonucleoside 3'-phosphate - Aniline or substituted anilines - Pyrimidone - Monoalkyl phosphate - Monocyclic benzene moiety - Hydropyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Alkyl phosphate - Benzenoid - Heteroaromatic compound - Vinylogous amide - Oxolane - Urea - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Amine - Organohalogen compound - Primary amine - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidine deoxyribonucleoside 3',5'-bisphosphates. These are pyrimidine ribobucleotides with one phosphate group attached to each of two different hydroxyl groups of the ribose moiety, which lacks a hydroxyl group at position 2.

External Descriptors

Not available

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