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
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
Isoleucine and derivatives Alpha amino acid esters Pyrimidones Fatty acid esters Benzenoids Phosphate esters Hydropyrimidines Vinylogous amides Oxolanes Carbamate esters Heteroaromatic compounds Ureas Carboxylic acid esters Lactams Azacyclic compounds Oxacyclic compounds Bromoalkenes Monocarboxylic acids and derivatives Vinyl bromides Hydrocarbon derivatives Organobromides Organonitrogen compounds Carbonyl compounds Organic oxides
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