Structure Information
Structure

Compound Identification

SMILES

CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@H]1C[C@@H](O[C@@H]1COP1(=O)OCC2=C(O1)C(C)=CC=C2)N1C=C(\C=C\Br)C(=O)NC1=O

InChIKey

InChIKey=OBMTXKTVTAGWDS-CISJIHLRSA-N

Formula

C30H39BrN3O11P

Mass

728.53

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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 heteropolycyclic compounds

Substituents

Pyrimidine 2'-deoxyribonucleoside monophosphate - Isoleucine or derivatives - Alpha-amino acid ester - Alpha-amino acid or derivatives - Pyrimidone - Fatty acid ester - Pyrimidine - Benzenoid - Phosphoric acid ester - Organic phosphoric acid derivative - Fatty acyl - Hydropyrimidine - Vinylogous amide - Carbamic acid ester - Oxolane - Heteroaromatic compound - Carboxylic acid ester - Lactam - Urea - Carboxylic acid derivative - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Carbonyl group - Organohalogen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic 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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