Cas no 475193-31-8 (2-Methylthioadenosine diphosphate trisodium)

2-Methylthioadenosine diphosphate trisodium is a modified nucleotide derivative widely used in biochemical and pharmacological research. Its key advantages include high purity and stability, making it suitable for enzymatic studies, particularly those involving methylthioadenosine phosphorylase (MTAP) and related pathways. The trisodium salt form enhances solubility in aqueous solutions, facilitating its use in in vitro assays. This compound serves as a valuable substrate or inhibitor in studies of purine metabolism, signal transduction, and methylation processes. Its structural similarity to natural nucleotides allows for precise investigation of enzyme mechanisms, while its synthetic modification provides specificity in targeting metabolic pathways.
2-Methylthioadenosine diphosphate trisodium structure
475193-31-8 structure
Product Name:2-Methylthioadenosine diphosphate trisodium
CAS No:475193-31-8
MF:C11H14N5Na3O10P2S
MW:539.238194942474
CID:931089
PubChem ID:52942441
Update Time:2025-07-31

2-Methylthioadenosine diphosphate trisodium Chemical and Physical Properties

Names and Identifiers

    • Trisodium 2-(methylsulfanyl)-5'-o-[(phosphonatooxy)phosphinato]ad Enosine
    • 2-(Methylthio)adenosine 5′-diphosphate trisodium salt hydrate
    • 2-Methylthioadenosine diphosphate trisodium salt
    • 2-Methylthioadenosine diphosphate trisodium
    • PD057165
    • 2-(Methylthio)adenosine 5'-diphosphate sodium salt
    • 2-(methylthio) adenosine 5'-diphosphate trisodium salt
    • 2-Mes-ADP
    • 475193-31-8
    • DYNGCIHMNWOBSU-MSQVLRTGSA-K
    • AKOS024456710
    • 2-Methylthio-ADP trisodium
    • CHEMBL1256972
    • DTXSID701017431
    • sodium ((2R,3S,4R,5R)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl diphosphate
    • 2-(METHYLTHIO)ADENOSINE 5'-DIPHOSPHATE TRISODIUM SALT 2-(METHYLTHIO)ADENOSINE 5'-DIPHOSPHATE TRISODIUM SALT 2-(METHYLTH
    • trisodium;[[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] phosphate
    • 2-(Methylthio)adenosine 5-diphosphate trisodium salt hydrate
    • 2-(Methylthio)adenosine-5'-(trihydrogen diphosphate) trisodium salt
    • EX-A9475
    • DA-69810
    • Inchi: 1S/C11H17N5O10P2S.3Na/c1-29-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(25-10)2-24-28(22,23)26-27(19,20)21;;;/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H2,12,14,15)(H2,19,20,21);;;/q;3*+1/p-3/t4-,6-,7-,10-;;;/m1.../s1
    • InChI Key: DYNGCIHMNWOBSU-MSQVLRTGSA-K
    • SMILES: S(C)C1N=C(C2=C(N=1)N(C=N2)[C@H]1[C@@H]([C@@H]([C@@H](COP(=O)([O-])OP(=O)([O-])[O-])O1)O)O)N.[Na+].[Na+].[Na+]

Computed Properties

  • Exact Mass: 538.963
  • Monoisotopic Mass: 538.963
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 15
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 6
  • Complexity: 669
  • Covalently-Bonded Unit Count: 4
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 266A^2

Experimental Properties

  • Density: 2.35
  • Boiling Point: 936.1°Cat760mmHg
  • Flash Point: 520°C
  • Refractive Index: 1.882
  • Solubility: H2O: >20mg/mL
  • PSA: 286.01000
  • LogP: 0.87170

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(CAS:475193-31-8)2-Methylthioadenosine diphosphate trisodium
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Amadis Chemical Company Limited
(CAS:475193-31-8)2-Methylthioadenosine diphosphate trisodium
A1029738
Purity:99%/99%/99%
Quantity:1mg/5mg/10mg
Price ($):244.0/752.0/1229.0
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NewCan Biotech Limited
(CAS:475193-31-8)2-Methylthioadenosine diphosphate trisodium
NC20207
Purity:97%
Quantity:10g
Price ($):Inquiry
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