Molecule ID: 25258213

IUPAC Name: (1R,2S,6S,16R)-16-methyl-5-oxa-7-azatetracyclo[5.4.3.32,6.01,6]heptadecane-4,11-dione

Description: The molecule is an alkaloid isolated from the club moss Lycopodium japonicum and has been shown to exhibit acetylcholinesterase inhibitory and anti-HIV-1 activity. It has a role as a metabolite, an EC 3.1.1.7 (acetylcholinesterase) inhibitor and an anti-HIV-1 agent. It is an alkaloid, a lactone, a cyclic ketone, a bridged compound and an organic heterotetracyclic compound.

SMILES: C[C@@H]1C[C@H]2CC(=O)O[C@]3(C1)N1CCCC(=O)[C@]23CCC1

SELFIES: [C][C@@H1][C][C@H1][C][C][=Branch1][C][=O][O][C@][Branch1][Ring2][C][Ring1][=Branch2][N][C][C][C][C][=Branch1][C][=O][C@][Ring1][=C][Ring1][=Branch2][C][C][C][Ring1][#Branch2]

InChI: InChI=1S/C16H23NO3/c1-11-8-12-9-14(19)20-16(10-11)15(12)5-3-7-17(16)6-2-4-13(15)18/h11-12H,2-10H2,1H3/t11-,12+,15+,16+/m1/s1

Molecular Properties:
- Polar Surface Area: 46.6 Ų
- LogP: 1.7