For research use only. Not for therapeutic Use.
Selective, high affinity <span class=/’symbol/’>α</span><sub>4</sub><span class=/’symbol/’>β</span><sub>1</sub> (Very Late Antigen 4; VLA-4) inhibitor; displays 200-fold selectivity for the activated form of <span class=/’symbol/’>α</span><sub>4</sub><span class=/’symbol/’>β</span><sub>1</sub> (K<sub>D</sub> = 70 pM; IC<sub>50</sub> = 0.004 <span class=/’symbol/’>μ</span>M). Selective for <span class=/’symbol/’>α</span><sub>4</sub><span class=/’symbol/’>β</span><sub>1</sub> over a range of other integrins (IC<sub>50</sub> >100 <span class=/’symbol/’>μ</span>M for <span class=/’symbol/’>α</span><sub>1</sub><span class=/’symbol/’>β</span><sub>1</sub>, <span class=/’symbol/’>α</span><sub>5</sub><span class=/’symbol/’>β</span><sub>1</sub> and <span class=/’symbol/’>α</span><sub>6</sub><span class=/’symbol/’>β</span><sub>1</sub>).
| CAS Number | 187735-94-0 |
| Molecular Formula | C36H48N6O9 |
| Purity | ≥95% |
| Target | Integrin |
| Solubility | Soluble to 2 mg/ml in 0.2M PBS |
| Storage | Store at -20C |
| IUPAC Name | (2S)-1-[(2S)-2-[[(2S)-3-carboxy-2-[[(2S)-4-methyl-2-[[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]amino]pentanoyl]amino]propanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid |
| InChI | InChI=1S/C36H48N6O9/c1-20(2)17-26(38-29(43)18-23-12-14-24(15-13-23)37-36(51)40-25-10-7-6-9-22(25)5)32(46)39-27(19-30(44)45)33(47)41-31(21(3)4)34(48)42-16-8-11-28(42)35(49)50/h6-7,9-10,12-15,20-21,26-28,31H,8,11,16-19H2,1-5H3,(H,38,43)(H,39,46)(H,41,47)(H,44,45)(H,49,50)(H2,37,40,51)/t26-,27-,28-,31-/m0/s1 |
| InChIKey | NVVGCQABIHSJSQ-KFZSMJGVSA-N |
| SMILES | CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)NC(CC(C)C)C(=O)NC(CC(=O)O)C(=O)NC(C(C)C)C(=O)N3CCCC3C(=O)O |
| Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |
