α-Truxilline

CAS: 490-17-5

Ref. TR-T895550

Product Information

• Name: α-Truxilline
• Synonyms: (1R,2R,3S,4S)-bis((1R,2R,3S,5S)-2-(Methoxycarbonyl)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2,4-Diphenylcyclobutane-1,3-dicarboxylate, (1α,2α,3β,4β)-2,4-Diphenyl-1,3-cyclobutanedicarboxylic Acid bis[(1R,2R,3S,5S)-2-(Methoxycarbonyl)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl] Ester, Bis[(1R,2R,3S,5S)-2-Methoxycarbonyl-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]2,4-di(phenyl)cyclobutane-1,3-dicarboxylate, Cocamin, Cocamine, γ-Isoatropylcocaine
• Brand: TRC
• Description: Applications α-Truxillin is an alkaloid found in coca leaves. It is an impurity of illicit Cocaine (C633500), which inhibits the dopamine, norepinephrine, and serotonin transporters.References Moore, J., et al.: J. Chromatogr. A, 659, 163 (1994); Lurie, I., et al.: Electrophoresis, 19, 51 (1998); Blakely, R.D., et al.: Curr. Opin. Neurobiol., 10, 328 (2000); Cowell, R. M., et al.: Eur. J. Pharmacol., 389, 59 (2000); Fleckenstein, A.E., Eur. J. Pharmacol., 406, 1 (2000); Torres, G.E., et al.: Nat. Rev. Neurosci., 4, 13 (2003)

Chemical properties

• Molecular weight: 658.78
• Formula: C₃₈H₄₆N₂O₈
• Color/Form: Off-White To Light Yellow
• InChI: InChI=1S/C38H46N2O8/c1-39-23-15-17-25(39)31(35(41)45-3)27(19-23)47-37(43)33-29(21-11-7-5-8-12-21)34(30(33)22-13-9-6-10-14-22)38(44)48-28-20-24-16-18-26(40(24)2)32(28)36(42)46-4/h5-14,23-34H,15-20H2,1-4H3/t23-,24-,25+,26+,27-,28-,29-,30-,31+,32+,33-,34-/m0/s1
• InChI key: InChIKey=BUOSLGZEBFSUDD-XFKBZBJISA-N
• SMILES: COC(=O)[C@H]1[C@@H](OC(=O)[C@H]2[C@H](c3ccccc3)[C@H](C(=O)O[C@H]3C[C@@H]4CC[C@H]([C@H]3C(=O)OC)N4C)[C@H]2c2ccccc2)C[C@@H]2CC[C@H]1N2C