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2-Methylthioadenosine diphosphate trisodium salt - ≥98%(HPLC), high purity , CAS No.475193-31-8

COA

Grade & Purity:

≥98%
10 mM solution in water

Cas Number: 475193-31-8
Molecular Weight: 539.24
PubChem CID: 52942441

In stock

Item Number

M288124

Grouped product items
SKU	Size	Availability	Price
M288124-10mg	10mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,336.90
M288124-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$193.90
M288124-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$860.90

Potent agonist at P2Y1, P2Y12and P2Y13

View related series

Agonists (7) Class A GPCR (4138) GPCR/G Protein (3172) P2Y Receptor (39)

Basic Description

Synonyms	2-Mes-ADP \| 2-Methylthioadenosine diphosphate trisodium \| 2-methylthio-ADP \| 2-Methylthio-ADP trisodium \| 2-(methylthio)-adenosine 5'-(trihydrogen diphosphate), trisodium salt \| 2MeSADP \| 2-MeSADP \| 2-methylthio ADP
Specifications & Purity	≥98%, 10 mM solution in water
Biochemical and Physiological Mechanisms	Potent purinergic agonist displaying selectivity for P2Y1, P2Y12and P2Y13receptors (pEC50= 8.29 and 9.05 for P2Y1and P2Y12, EC50= 19 nM for P2Y13). Induces aggregation of, and inhibits cAMP accumulation in, plateletsin vitro.
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Nucleosides, nucleotides, and analogues
  - Class Purine nucleotides
    - Subclass Purine ribonucleotides

Kingdom	Organic compounds
Superclass	Nucleosides, nucleotides, and analogues
Class	Purine nucleotides
Subclass	Purine ribonucleotides
Intermediate Tree Nodes	Not available
Direct Parent	Purine ribonucleoside diphosphates
Alternative Parents	Purine ribonucleoside monophosphates Pentose phosphates Glycosylamines 6-aminopurines Organic pyrophosphates Monosaccharide phosphates Alkylarylthioethers Aminopyrimidines and derivatives Alkyl phosphates N-substituted imidazoles Imidolactams Oxolanes Heteroaromatic compounds 1,2-diols Secondary alcohols Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organic sodium salts Organic zwitterions Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Purine ribonucleoside diphosphate - Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Monosaccharide phosphate - Organic pyrophosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Aryl thioether - Aminopyrimidine - Alkylarylthioether - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Pyrimidine - Alkyl phosphate - Azole - Oxolane - Imidazole - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Sulfenyl compound - Thioether - Organoheterocyclic compound - Organic alkali metal salt - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organic zwitterion - Organic sodium salt - Amine - Primary amine - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as purine ribonucleoside diphosphates. These are purine ribobucleotides with diphosphate group linked to the ribose moiety.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	trisodium;[[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] phosphate
INCHI	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
InChIKey	DYNGCIHMNWOBSU-MSQVLRTGSA-K
Smiles	CSC1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)([O-])OP(=O)([O-])[O-])O)O)N.[Na+].[Na+].[Na+]
Isomeric SMILES	CSC1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])OP(=O)([O-])[O-])O)O)N.[Na+].[Na+].[Na+]
PubChem CID	52942441
Molecular Weight	539.24

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Solubility	PBS (pH 7.2): 10 mg/ml；Water: soluble
Molecular Weight	539.240 g/mol
XLogP3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	6
Exact Mass	538.963 Da
Monoisotopic Mass	538.963 Da
Topological Polar Surface Area	266.000 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	669.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	4

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