Isopentyl (2R)-Orlistat Tetradecyl Ester

CAS: 1356019-68-5

Ref. TR-I821998

Product Information

• Name: Isopentyl (2R)-Orlistat Tetradecyl Ester
• Synonyms: (2R)-(2S)-1-((2S,3S)-3-(2-Methylbutyl)-4-oxooxetan-2-yl)pentadecan-2-yl 2-Formamido-4-methylpentanoate
• CAS: 1356019-68-5

Description

Applications Isopentyl (2R)-Orlistat Tetradecyl Ester is a by-product in the synthesis of Isopentyl Orlistat Tetradecyl Ester (I821900), which is an Orlistat (O686500) impurity. Orlistat is an antiobesity agent. Orlistat (O686500) is an pancreatic lipase inhibitor.
References Borgstrom, B., et al.: Biochim. Biophys. Acta, 962, 308 (1988); Hauptman, J.B., et al.: Am. J. Clin. Nutr., 55, 309S (1992); McNeely, W., et al.: Drugs, 56, 241 (1998); Hauptman, J. B., et al.: Arch. Fam. Med., 9, 160 (2000)

• Brand: TRC

Chemical properties

• Molecular weight: 509.76
• Formula: C₃₀H₅₅NO₅
• Color/Form: Neat
• InChI: InChI=1S/C30H55NO5/c1-6-8-9-10-11-12-13-14-15-16-17-18-25(35-30(34)27(31-22-32)19-23(3)4)21-28-26(29(33)36-28)20-24(5)7-2/h22-28H,6-21H2,1-5H3,(H,31,32)/t24?,25-,26-,27+,28-/m0/s1
• InChI key: InChIKey=HJYUNNNEBYSZMW-DSBKNIPBSA-N
• SMILES: CCCCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CC(C)CC)OC(=O)[C@@H](CC(C)C)NC=O