Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)N(C=C1)C1CC(O)C(COP(O)(=O)OCCOCCOCCOP(O)(=O)OC2CC(OC2COP(O)(=O)OCCOCCOCCOCCOCCOCCOP(O)(=O)OCCOCCOCCOCCOCCOCCO)N2C=C(\C=C\C(=O)NCCCCCCNC(=O)C3=CC(=C(C=C3)C(O)=O)C3=C4C=CC(=O)C=C4OC4=C3C=CC(O)=C4)C(=O)NC2=O)O1

InChIKey

InChIKey=WLIRHTHNCLLUBC-WUXMJOGZSA-N

Formula

C78H113N7O42P4

Mass

1944.664

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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 heteropolycyclic compounds

Substituents

Pyrimidine deoxyribonucleoside 3',5'-bisphosphate - Pyrimidine 2'-deoxyribonucleoside monophosphate - Ribonucleoside 3'-phosphate - Dibenzopyran - Xanthene - Polyethylene glycol - 1-benzopyran - Benzopyran - Benzoic acid or derivatives - Benzoic acid - Benzamide - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Aminopyrimidine - Pyrimidone - Phenol - Dialkyl phosphate - Hydropyrimidine - Imidolactam - Pyrimidine - Organic phosphoric acid derivative - Alkyl phosphate - Monocyclic benzene moiety - Phosphoric acid ester - Benzenoid - Vinylogous amide - Heteroaromatic compound - Oxolane - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Urea - Amino acid or derivatives - Lactam - Cyclic ketone - Amino acid - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Carbonyl group - Primary amine - Organic nitrogen compound - Amine - Alcohol - Primary alcohol - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic 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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