Grundinformationen
- Standard-SMILES
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O- InChIKey
NHVNXKFIZYSCEB-XLPZGREQSA-N- Summenformel
- C10H17N2O14P3
- Durchschnittliche Molmasse
- 482,17 g/mol
- Monoisotopische Masse
- 481,98926311
Überblick
DTTP is a thymidine phosphate having a triphosphate group at the 5'-position. It has a role as a mouse metabolite and an Escherichia coli metabolite. It is a thymidine phosphate and a pyrimidine 2'-deoxyribonucleoside 5'-triphosphate. It is a conjugate acid of a dTTP(3-).
Namen und Bezeichner
- Bevorzugter Name
- dTTP
- IUPAC
- [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate
- Lokaler Name
- Thymidin-5'-(tetrahydrogentriphosphat)
- Englischer Name
- thymidine 5'-(tetrahydrogen triphosphate)
- Summenformel
- C10H17N2O14P3
- Molmasse
- 482.17
Namen und Synonyme
dTTP365-08-2thymidine 5'-triphosphateDeoxy-TTP2'-Deoxythymidine triphosphate5'-TTPthymidine triphosphateDeoxythymidine 5'-triphosphateTTP (nucleotide)pppdTQOP4K539MUCHEBI:18077
Weitere Namen anzeigen
dTTPS5-Methyl-dUTPdTTP.Free AcidThymidine Impurity 5dTTP 100mM Sodium Solution2'-Deoxythymidine triposphateDeoxythymidine-5'-triphosphateThymidine-5'-Triphosphoric Acid
DTXSID30189998RefChem:898076DTXCID901124892'-deoxythymidine-5'-triphosphate((hydroxy(((hydroxy((((2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl)methoxy))phosphoryl)oxy))phosphoryl)oxy)phosphonic acid206-669-7THYMIDINE-5'-TRIPHOSPHATEthymidine 5'-(tetrahydrogen triphosphate)
Datenbank-Bezeichner
- CAS
365-08-2- PubChem CID
- 64968
- DTXSID
DTXSID30189998- ChEMBL
CHEMBL363559- ChEBI
CHEBI:18077- UNII
- QOP4K539MU
- EC Number
- 206-669-7
- Nikkaji
- J193.870C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -5
- Polarare Oberfläche (TPSA)
- 239 Ų
- H-Brücken-Donoren
- 6
- H-Brücken-Akzeptoren
- 14
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 29
- Formalladung
- 0
- Komplexität
- 853
Experimentelle und physikochemische Eigenschaften
Chemical ClassesBiological Agents -> Nucleic Acids and Derivatives
DrugsPharmaceuticals -> Listed in ZINC15
Physical Description
Odorless solid; [GE Healthcare MSDS]
Solid
Collision Cross Section207.41 Ų [M+Na]+ [CCS Type: DT; Method: stepped-field]
Physikochemische Eigenschaften
- storage temp.
- 2 · 2-8°C
- Dichte
- 1.922 · 1.922±0.06 g/cm3(Predicted)
- pka
- 0.8 · 0.80±0.50(Predicted)
- Aggregatzustand
- Liquid
- Farbe
- Colorless to light yellow
Sicherheit und Regulatorisches
Gefahrenhinweise
Hazards SummaryMay cause mucous membrane and upper respiratory tract injury, based on animal studies; [GE Healthcare MSDS]
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsMitochondria
Metabolite PathwaysBeta Ureidopropionase Deficiency
Verwendung und Herstellung
UsesUsed in analytical chemistry and research; [GE Healthcare MSDS]
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