Compound Identification
SMILES
O[C@H]1C[C@@H](O[C@@H]1CO[P@@]1(=O)OCC2=CC=CC(C3=CC=CC=C3)=C2O1)N1C=C(\C=C\Br)C(=O)NC1=O
InChIKey
InChIKey=PQSKDQPWYIFPAG-VALDLAPPSA-N
Formula
C24H22BrN2O8P
Mass
577.324
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
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
Pyrimidones Phosphate esters Benzene and substituted derivatives Hydropyrimidines Vinylogous amides Oxolanes Heteroaromatic compounds Ureas Secondary alcohols Lactams Vinyl bromides Oxacyclic compounds Azacyclic compounds Bromoalkenes Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidine 2'-deoxyribonucleoside monophosphate - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Benzenoid - Heteroaromatic compound - Oxolane - Vinylogous amide - Lactam - Secondary alcohol - Urea - Oxacycle - Azacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Organooxygen compound - Organonitrogen compound - Organobromide - Alcohol - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organohalogen compound - Hydrocarbon derivative - 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