MedKoo Cat#: 532303 | Name: MRS3558

Description:

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

MRS3558 is an A3 adenosine receptors Agonist.

Chemical Structure

MRS3558
MRS3558
CAS#793695-40-6

Theoretical Analysis

MedKoo Cat#: 532303

Name: MRS3558

CAS#: 793695-40-6

Chemical Formula: C20H20Cl2N6O3

Exact Mass: 462.0974

Molecular Weight: 463.32

Elemental Analysis: C, 51.85; H, 4.35; Cl, 15.30; N, 18.14; O, 10.36

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 #
No Data
Synonym
MRS3558; MRS 3558; MRS-3558.
IUPAC/Chemical Name
(1S,2R,3S,4R,5S)-4-[2-chloro-6-[(3-chlorophenyl)methylamino]purin-9-yl]-2,3-dihydroxy-N-methylbicyclo[3.1.0]hexane-1-carboxamide
InChi Key
WBUOCDGSBFEIOR-DDDALXFXSA-N
InChi Code
InChI=1S/C20H20Cl2N6O3/c1-23-18(31)20-7-11(20)13(14(29)15(20)30)28-8-24-12-16(25-19(22)26-17(12)28)27(2)10-5-3-4-9(21)6-10/h3-6,8,11,13-15,29-30H,7H2,1-2H3,(H,23,31)/t11-,13-,14+,15+,20+/m1/s1
SMILES Code
O=C([C@]12[C@@H](O)[C@@H](O)[C@H](N3C=NC4=C(N(C5=CC=CC(Cl)=C5)C)N=C(Cl)N=C34)[C@@]1([H])C2)NC
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 463.32 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: Hu H, Lu W, Zhang M, Zhang X, Argall AJ, Patel S, Lee GE, Kim YC, Jacobson KA, Laties AM, Mitchell CH. Stimulation of the P2X7 receptor kills rat retinal ganglion cells in vivo. Exp Eye Res. 2010 Sep;91(3):425-32. doi: 10.1016/j.exer.2010.06.017. Epub 2010 Jul 1. PubMed PMID: 20599962; PubMed Central PMCID: PMC2941978. 2: Matot I, Einav S, Weiniger CF, Pearl RG, Abramovitch R, Joshi BV, Jacobson KA. Lung injury after in vivo reperfusion: outcome at 27 hours after reperfusion. Anesthesiology. 2008 Aug;109(2):269-78. doi: 10.1097/ALN.0b013e31817f5b90. PubMed PMID: 18648236; PubMed Central PMCID: PMC2688693. 3: Gao ZG, Jacobson KA. Translocation of arrestin induced by human A(3) adenosine receptor ligands in an engineered cell line: comparison with G protein-dependent pathways. Pharmacol Res. 2008 Apr;57(4):303-11. doi: 10.1016/j.phrs.2008.02.008. Epub 2008 Mar 8. PubMed PMID: 18424164; PubMed Central PMCID: PMC2409065. 4: Matot I, Weiniger CF, Zeira E, Galun E, Joshi BV, Jacobson KA. A3 adenosine receptors and mitogen-activated protein kinases in lung injury following in vivo reperfusion. Crit Care. 2006;10(2):R65. PubMed PMID: 16623960; PubMed Central PMCID: PMC1550918. 5: Joshi BV, Jacobson KA. Purine derivatives as ligands for A3 adenosine receptors. Curr Top Med Chem. 2005;5(13):1275-95. Review. PubMed PMID: 16305531.