Compound Identification
SMILES
COC(CC1=CC=CC=C1)O[C@@H]1C[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@@H]3OC(CC4=CC=CC=C4)O[C@H]23)N2C=CC(=O)NC2=O)O[C@H]1N1C=NC2=C1N=C(SCCC(F)(F)F)N=C2NCCSC
InChIKey
InChIKey=XUPFHWRMDWCPIF-KISRQMKWSA-N
Formula
C42H52F3N7O21P4S2
Mass
1235.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
- Class (5'->5')-dinucleotides
-
Superclass
Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
(5'->5')-dinucleotides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
(5'->5')-dinucleotides
Alternative Parents
Purine 3'-deoxyribonucleoside polyphosphates Purine nucleotide sugars Pentose phosphates 6-alkylaminopurines Monosaccharide phosphates Secondary alkylarylamines Pyrimidones Alkylarylthioethers Aminopyrimidines and derivatives Monoalkyl phosphates Benzene and substituted derivatives N-substituted imidazoles Imidolactams Hydropyrimidines Oxolanes Vinylogous amides 1,3-dioxolanes Heteroaromatic compounds Ureas Lactams Sulfenyl compounds Oxacyclic compounds Acetals Azacyclic compounds Dialkylthioethers Organofluorides Alkyl fluorides Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
(5'->5')-dinucleotide - Purine 3'-deoxyribonucleoside polyphosphate - Purine nucleotide sugar - Pentose phosphate - Pentose-5-phosphate - 6-alkylaminopurine - 6-aminopurine - Monosaccharide phosphate - Purine - Imidazopyrimidine - Aryl thioether - Pyrimidone - Secondary aliphatic/aromatic amine - Aminopyrimidine - Monoalkyl phosphate - Alkylarylthioether - Alkyl phosphate - Monocyclic benzene moiety - Hydropyrimidine - N-substituted imidazole - Phosphoric acid ester - Pyrimidine - Benzenoid - Monosaccharide - Organic phosphoric acid derivative - Imidolactam - Heteroaromatic compound - Vinylogous amide - Meta-dioxolane - Imidazole - Azole - Oxolane - Urea - Lactam - Azacycle - Oxacycle - Acetal - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Organopnictogen compound - Alkyl fluoride - Organic oxide - Hydrocarbon derivative - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organohalogen compound - Organooxygen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as (5'->5')-dinucleotides. These are dinucleotides where the two bases are connected via a (5'->5')-phosphodiester linkage.
External Descriptors
Not available