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NIBR-0213
AOB1113
CAS 1233332-14-3
Chemical Name: 2(S)-({3'-[1(R)-(4-Chloro-3-methyl-phenyl)-ethylamino]-3,5-dimethyl-biphenyl-4-carbonyl}-amino)-propionic acid
AOBIOUS launched this product in 2015
Citation (Publications used AOBIOUS products):
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Quantity Discount Table - Order More To Get More Price Discount
| Quantity | mg | Unit Price ($/mg or $/Unit) | Final Price |
|---|---|---|---|
| 1 | 100 | $6.75 | Total: $675.00 |
| 1 | 50 | $7.80 | Total: $390.00 |
| 1 | 25 | $9.15 | Total: $228.75 |
| 1 | 10 | $10.80 | Total: $108.00 |
| 1 | 5 | $12.75 | Total: $63.75 |
Data sheet
| Molecular Formula | C27H29ClN2O3 |
| Molecular Weight | 464.98 |
| CAS Numbers | 1233332-14-3 |
| Storage Condition | 0°C (short term), -20°C (long term), desiccated |
| Solubility | DMF: 25 mg/mL DMSO: 25 mg/mL Ethanol: 25 mg/mL Ethanol:PBS(pH 7.2) (1:5): 0.15 mg/mL |
| Purity | 98% by HPLC |
| Synonym | NIBR0213; NIBR 0213 |
| IUPAC/Chemical Name | N-[[3'-[[(1R)-1-(4-chloro-3-methylphenyl)ethyl]amino]-3,5-dimethyl[1,1'-biphenyl]-4-yl]carbonyl]-L-alanine |
| InChl Key | KYHUARFFBDLROH-MOPGFXCFSA-N |
| InChl Code | InChI=1S/C27H29ClN2O3/c1-15-11-20(9-10-24(15)28)18(4)29-23-8-6-7-21(14-23)22-12-16(2)25(17(3)13-22)26(31)30-19(5)27(32)33/h6-14,18-19,29H,1-5H3,(H,30,31)(H,32,33)/t18-,19+/m1/s1 |
| SMILES Code | CC1=C(Cl)C=CC([C@@H](C)NC2=CC(C3=CC(C)=C(C(N[C@@H](C)C(O)=O)=O)C(C)=C3)=CC=C2)=C1 |
| References | 1) Quancard, J., Bollbuck, B., Janser, P., et al. A potent and selective S1P1 antagonist with efficacy in experimental autoimmune encephalomyelitis. Chem. Biol. 19(9), 1142-1151 (2012). 2) Huwiler, A., Kolter, T., Pfeilschifter, J., et al. Physiology and pathophysiology of sphingolipid metabolism and signaling. Biochim. Biophys. Acta. 1485(2-3), 63-99 (2000). |
More info
Potent and Selective S1P(1) Antagonist with Efficacy in Experimental Autoimmune Encephalomyelitis
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