CAS 129048-22-2

benzyl (2S,3aS,6aS)-1-{(2S)-2-[(tert-butoxycarbonyl)amino]propanoyl}octahydrocyclopenta[b]pyrrole-2-carboxylate (non-preferred name)

Description:

Benzyl (2S,3aS,6aS)-1-{(2S)-2-[(tert-butoxycarbonyl)amino]propanoyl}octahydrocyclopenta[b]pyrrole-2-carboxylate, with the CAS number 129048-22-2, is a complex organic compound characterized by its bicyclic structure, which includes a cyclopentane and pyrrole moiety. This compound features a benzyl group, a tert-butoxycarbonyl (Boc) protecting group, and an octahydro framework, indicating it is likely to be a derivative of a natural product or a synthetic intermediate in pharmaceutical chemistry. The presence of multiple stereocenters suggests that it may exhibit stereoisomerism, which can influence its biological activity and interactions. The tert-butoxycarbonyl group is commonly used in peptide synthesis to protect amine functionalities, indicating potential applications in medicinal chemistry. Overall, this compound's structural complexity and functional groups suggest it may play a role in drug development or as a research chemical in the study of biological systems.

Formula: C₂₃H₃₂N₂O₅

InChI: InChI=1/C23H32N2O5/c1-15(24-22(28)30-23(2,3)4)20(26)25-18-12-8-11-17(18)13-19(25)21(27)29-14-16-9-6-5-7-10-16/h5-7,9-10,15,17-19H,8,11-14H2,1-4H3,(H,24,28)/t15-,17-,18-,19-/m0/s1

SMILES: C[C@@H](C(=O)N1[C@H]2CCC[C@H]2C[C@H]1C(=O)OCc1ccccc1)N=C(O)OC(C)(C)C