(2R,3R,3aS,9bS)-1-acetyl-7-(1-cyclopentenyl)-3-(hydroxymethyl)-6-oxo-N-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

Properties Image MNX_ID MNXM170523 reference chebi:102234 formula C25H27N3O4 global charge 0 mol weight 433.508 InChIKey CIRAGUKJUQGHED-YXPKMTABSA-N InChI InChI=1S/C25H27N3O4/c1-15(30)28-22-19(20(14-29)23(28)24(31)26-17-9-3-2-4-10-17)13-27-21(22)12-11-18(25(27)32)16-7-5-6-8-16/h2-4,7,9-12,19-20,22-23,29H,5-6,8,13-14H2,1H3,(H,26,31)/t19-,20-,22+,23-/m1/s1 SMILES CC(=O)N1[C@@H]2C3=CC=C(C4=CCCC4)C(=O)N3C[C@@H]2[C@@H](CO)[C@@H]1C(=O)NC1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C25H27N3O4/c1-15(30)28-22-19(20(14-29)23(28)24(31)26-17-9-3-2-4-10-17)13-27-21(22)12-11-18(25(27)32)16-7-5-6-8-16/h2-4,7,9-12,19-20,22-23,29H,5-6,8,13-14H2,1H3,(H,26,31)/t19-,20-,22+,23-/m1/s1 SMILES (mnx) [CH3:1][C:15]([N:28]1[C@H:22]2[C@H:19]([CH2:13][N:27]3[C:21]2=[CH:12][CH:11]=[C:18]([C:16]2=[CH:7][CH2:5][CH2:6][CH2:8]2)[C:25]3=[O:32])[C@@H:20]([CH2:14][OH:29])[C@@H:23]1[C:24](=[N:26][C:17]1=[CH:9][CH:3]=[CH:2][CH:4]=[CH:10]1)[OH:31])=[O:30]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0