Thymidylyl-(3'->5')-thymidine
Basic information
- CAS
1969-54-6- Standard SMILES
Cc1cn([C@H]2C[C@H](OP(=O)(O)OC[C@H]3O[C@@H](n4cc(C)c(=O)[nH]c4=O)C[C@@H]3O)[C@@H](CO)O2)c(=O)[nH]c1=O- InChIKey
FCXGCSBZKOHCLB-KPRKPIBOSA-N- Molecular formula
- C20H27N4O12P
- Average molar mass
- 546.4 g/mol
- Monoisotopic mass
- 546.13630931
Overview
DT2 is an oligonucleotide comprised of two thymidine residues connected via a 3'5' phosphodiester linkage. It contains a dTMP 3'-end residue.
Names & identifiers
- Preferred name
- Thymidylyl-(3'->5')-thymidine
- IUPAC
- [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hydrogen phosphate
- English name
- THYMIDYLYL(3'->5')THYMIDINE AMMONIUM SALT
- Molecular formula
- C20H27N4O12P
- Molecular weight
- 546.42
Names & synonyms
thymidylyl-(3'->5')-thymidine1969-54-6RefChem:385617CHEBI:75710DT2dithymidine phosphateEpitope ID:190611thymidylyl(3'-5')thymidinedithymidine 3',5'-phosphatedithymidylyl-3',5'-phosphatethymidylyl (3',5')thymidineSCHEMBL8529362
Show more names
tptTPT AMMONIUM SALTthymidylyl-(3’-5’)-thymidineThymidine, thymidylyl-(3'→5')-thymidylyl(3'5')thymidine ammoniumTHYMIDYLYL(3'->5')THYMIDINE AMMONIUM SALT
thymidylyl-(3' 5')-thymidineCHEMBL3608398thymidylyl-(5'->3')-thymidineDTXSID701309371Thymidylyl-(3a(2)a5a(2))-thymidinethymidylyl-(3',5')-thymidine phosphateQ27145492[(2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-2-yl]methyl (2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-3-yl hydrogen phosphate
Database identifiers
- CAS
1969-54-6
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 214 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 1,100
Physicochemical properties
- Melting point
- 4 °C · 4.0 °C
- Density
- 1.66 · 1.66±0.1 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 1.37 · 1.37±0.50(Predicted)
- form
- Solid
- color
- White to Off-White
- Stability
- Hygroscopic
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Applications
UsesThymidylyl-3''-5''-thymidine ammonium salt is used for skin photo-protection and repairs. A nucleoside.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…