CAS 108051-94-1

[(1S)-1-[[(2S,3S)-3-hexyl-4-oxo-oxetan-2-yl]methyl]dodecyl] (2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoate

Description:

The chemical substance with the name "[(1S)-1-[[(2S,3S)-3-hexyl-4-oxo-oxetan-2-yl]methyl]dodecyl] (2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoate" and CAS number "108051-94-1" is a complex organic compound characterized by its multi-functional structure. It features a long aliphatic chain, which contributes to its hydrophobic properties, alongside a cyclic oxetan moiety that introduces unique steric and electronic characteristics. The presence of a benzyloxycarbonylamino group indicates potential for interactions in biological systems, suggesting applications in pharmaceuticals or biochemistry. The stereochemistry, denoted by the (S) configurations, implies specific spatial arrangements that can influence the compound's reactivity and interactions with biological targets. Overall, this compound exemplifies the intricate design often found in synthetic organic chemistry, where specific functional groups and stereochemistry are tailored for desired properties and activities. Its complexity may also suggest challenges in synthesis and characterization, making it a subject of interest in advanced chemical research.

Formula: C₃₆H₅₉NO₆

InChI: InChI=1/C36H59NO6/c1-5-7-9-11-12-13-14-15-19-23-30(26-33-31(34(38)43-33)24-20-10-8-6-2)42-35(39)32(25-28(3)4)37-36(40)41-27-29-21-17-16-18-22-29/h16-18,21-22,28,30-33H,5-15,19-20,23-27H2,1-4H3,(H,37,40)/t30-,31-,32-,33-/m0/s1

SMILES: CCCCCCCCCCC[C@@H](C[C@H]1[C@H](CCCCCC)C(=O)O1)OC(=O)[C@H](CC(C)C)N=C(O)OCc1ccccc1

Synonyms:

• N-[(PhenylMethoxy)carbonyl]-L-Leucine (1S)-1-[[(2S,3S)-3-Hexyl-4
• L-Leucine, N-[(phenylmethoxy)carbonyl]-, (1S)-1-[[(2S,3S)-3-hexyl-4-oxo-2-oxetanyl]methyl]dodecyl ester
• -oxo-2-oxetanyl]Methyl]dodecyl Ester

N-Deformyl-N-benzyloxycarbonyl Orlistat

Controlled Product

CAS: 108051-94-1

Formula: C₃₆H₅₉NO₆

Color and Shape: Neat

Molecular weight: 601.857

Ref: TR-D229050