MedKoo Cat#: 532284 | Name: MRS 2211 sodium salt hydrate

Description:

WARNING: This product is for research use only, not for human or veterinary use.

MRS 2211 sodium salt hydrate is a selective P2Y13 purinoceptor antagonist (pIC50 = 5.97, pA2 = 6.3). MRS 2211 sodium salt hydrate displays >20-fold selectivity for P2Y13 in comparison to P2Y1 and P2Y12 receptors. It is a first selective antagonist for this receptor subtype.

Chemical Structure

MRS 2211 sodium salt hydrate
MRS 2211 sodium salt hydrate
CAS#NA

Theoretical Analysis

MedKoo Cat#: 532284

Name: MRS 2211 sodium salt hydrate

CAS#: NA

Chemical Formula: C14H13ClN4Na3O10P

Exact Mass:

Molecular Weight: 532.67

Elemental Analysis: C, 31.57; H, 2.46; Cl, 6.66; N, 10.52; Na, 12.95; O, 30.04; P, 5.81

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
MRS 2211(219554-11-7); MRS 2211 sodium salt hydrate (NA).
Synonym
MRS 2211 sodium salt hydrate; MRS 2211; MRS2211; MRS-2211.
IUPAC/Chemical Name
2-[(2-Chloro-5-nitrophenyl)azo]-5-hydroxy-6-methyl-3-[(phosphonooxy)methyl]-4-pyridinecarboxaldehyde sodium salt hydrate sodium salt hydrate
InChi Key
OBBPSMHRAMOSRS-SOIHCWMDSA-K
InChi Code
InChI=1S/C14H12ClN4O8P.3Na.2H2O/c1-7-13(21)9(5-20)10(6-27-28(24,25)26)14(16-7)18-17-12-4-8(19(22)23)2-3-11(12)15;;;;;/h2-5,21H,6H2,1H3,(H2,24,25,26);;;;2*1H2/q;3*+1;;/p-3/b18-17+;;;;;
SMILES Code
O=CC1=C(COP([O-])([O-])=O)C(/N=N/C2=CC([N+]([O-])=O)=CC=C2Cl)=NC(C)=C1[O-].[H]O[H].[H]O[H].[Na+].[Na+].[Na+]
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 532.67 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Certal M, Vinhas A, Barros-Barbosa A, Ferreirinha F, Costa MA, Correia-de-Sá P. ADP-Induced Ca(2+) Signaling and Proliferation of Rat Ventricular Myofibroblasts Depend on Phospholipase C-Linked TRP Channels Activation Within Lipid Rafts. J Cell Physiol. 2017 Jun;232(6):1511-1526. doi: 10.1002/jcp.25656. Epub 2016 Nov 10. PubMed PMID: 27755650. 2: Guarracino JF, Cinalli AR, Fernández V, Roquel LI, Losavio AS. P2Y13 receptors mediate presynaptic inhibition of acetylcholine release induced by adenine nucleotides at the mouse neuromuscular junction. Neuroscience. 2016 Jun 21;326:31-44. doi: 10.1016/j.neuroscience.2016.03.066. Epub 2016 Apr 4. PubMed PMID: 27058149. 3: Mader F, Krause L, Tokay T, Hakenberg OW, Köhling R, Kirschstein T. P2Y receptor-mediated transient relaxation of rat longitudinal ileum preparations involves phospholipase C activation, intracellular Ca(2+) release and SK channel activation. Acta Pharmacol Sin. 2016 May;37(5):617-28. doi: 10.1038/aps.2015.137. Epub 2016 Mar 28. PubMed PMID: 27018177; PubMed Central PMCID: PMC4857539. 4: Zeng J, Wang G, Liu X, Wang C, Tian H, Liu A, Jin H, Luo X, Chen Y. P2Y13 receptor-mediated rapid increase in intracellular calcium induced by ADP in cultured dorsal spinal cord microglia. Neurochem Res. 2014 Nov;39(11):2240-50. doi: 10.1007/s11064-014-1426-8. Epub 2014 Sep 4. PubMed PMID: 25186167.