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CYM-5442
产品别名
1094042-01-9
CYM-5442
2-(4-(5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-inden-1-yl amino) ethanol
结构式
基本信息
Empirical Formula【经验(实验)分子式】 | C23H27N3O4 |
Molecular weight | 409.48 |
MDL number | MFCD12912402 |
PubChem Substance ID【PubChem化学物质编号】 | 329774920 |
NACRES | NA.77 |
Biochem/physiol Actions【生化/生理作用】 | CYM-5442 is a highly-selective S1P1 (Spingosine 1-Phosphate Receptor 1) agonist that activates S1P1-dependent pathways in vitro and to levels of full efficacy in vivo through a hydrophobic pocket, separable from the orthosteric site of S1P binding that is headgroup dependent. This is a different site from those involved in the activities of other agonists such as FTY720 and SEW2871. |
产品性质
Quality Level【质量水平】 | 100 |
Assay【测定】 | ≥98% (HPLC) |
solubility【溶解性】 | DMSO: >5 mg/mL |
storage temp.【储存温度】 | −20℃ |
SMILES string | CCOc1ccc(cc1OCC)-c2nc(no2)-c3cccc4C(CCc34)NCCO |
InChI | 1S/C23H27N3O4/c1-3-28-20-11-8-15(14-21(20)29-4-2)23-25-22(26-30-23)18-7-5-6-17-16(18)9-10-19(17)24-12-13-27/h5-8,11,14,19,24,27H,3-4,9-10,12-13H2,1-2H3 |
InChI key | NUIKTBLZSPQGCP-UHFFFAOYSA-N |
packaging【包装】 | 5, 25 mg in glass bottle |
安全信息
Storage Class Code【储存分类代码】 | 11 - Combustible Solids |
WGK | WGK 3 |
Personal Protective Equipment【个人防护装备】 | Eyeshields, Gloves, type N95 (US) |