(2S,3S,3aR,9bR)-3-(hydroxymethyl)-6-oxo-N-(2-piperidin-1-ylethyl)-1-(pyridin-2-ylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide

Properties Image MNX_ID MNXM171647 reference chebi:97695 formula C25H33N5O3 global charge 0 mol weight 451.571 InChIKey KUOHVPUFFVLNET-JVODISISSA-N InChI InChI=1S/C25H33N5O3/c31-17-20-19-16-29-21(8-6-9-22(29)32)23(19)30(15-18-7-2-3-10-26-18)24(20)25(33)27-11-14-28-12-4-1-5-13-28/h2-3,6-10,19-20,23-24,31H,1,4-5,11-17H2,(H,27,33)/t19-,20-,23+,24-/m0/s1 SMILES O=C(NCCN1CCCCC1)[C@@H]1[C@@H](CO)[C@@H]2CN3C(=O)C=CC=C3[C@@H]2N1CC1=CC=CC=N1 MNX internals InChI (mnx) InChI=1/C25H33N5O3/c31-17-20-19-16-29-21(8-6-9-22(29)32)23(19)30(15-18-7-2-3-10-26-18)24(20)25(33)27-11-14-28-12-4-1-5-13-28/h2-3,6-10,19-20,23-24,31H,1,4-5,11-17H2,(H,27,33)/t19-,20-,23+,24-/m0/s1 SMILES (mnx) [CH2:1]1[CH2:4][CH2:12][N:28]([CH2:14][CH2:11][N:27]=[C:25]([C@@H:24]2[C@@H:20]([CH2:17][OH:31])[C@@H:19]3[CH2:16][N:29]4[C:21](=[CH:8][CH:6]=[CH:9][C:22]4=[O:32])[C@@H:23]3[N:30]2[CH2:15][C:18]2=[CH:7][CH:2]=[CH:3][CH:10]=[N:26]2)[OH:33])[CH2:13][CH2:5]1

Parent-child relations graph

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