Compound Identification
SMILES
CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OC3=CC=C(C=C3)[N+]([O-])=O)O2)C(=O)NC1=O
InChIKey
InChIKey=RWOAVOYBVRQNIZ-BFHYXJOUSA-N
Formula
C16H18N3O10P
Mass
443.305
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
Nitrobenzenes Nitroaromatic compounds Phenoxy compounds Monoalkyl phosphates Pyrimidones Hydropyrimidines Tetrahydrofurans Vinylogous amides Heteroaromatic compounds Ureas Lactams Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidine 2'-deoxyribonucleoside monophosphate - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Monoalkyl phosphate - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Alkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Benzenoid - Tetrahydrofuran - Heteroaromatic compound - Vinylogous amide - Secondary alcohol - Organic nitro compound - C-nitro compound - Urea - Lactam - Organic oxoazanium - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alcohol - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic 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
CHEBI:74144 : C-nitro compound - aryl phosphate - pyrimidine 2'-deoxyribonucleoside 5'-monophosphate