(2S,3S)-8-(1-cyclohexenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

Properties Image MNX_ID MNXM171553 reference chebi:127351 formula C27H36N4O3 global charge 0 mol weight 464.61 InChIKey LZXHUUDTJFFTFM-ZYLNGJIFSA-N InChI InChI=1S/C27H36N4O3/c1-19-15-31(20(2)18-32)27(33)24-13-23(22-7-5-4-6-8-22)14-29-26(24)34-25(19)17-30(3)16-21-9-11-28-12-10-21/h7,9-14,19-20,25,32H,4-6,8,15-18H2,1-3H3/t19-,20-,25+/m0/s1 SMILES C[C@H]1CN([C@@H](C)CO)C(=O)C2=C(N=CC(C3=CCCCC3)=C2)O[C@@H]1CN(C)CC1=CC=NC=C1 MNX internals InChI (mnx) InChI=1/C27H36N4O3/c1-19-15-31(20(2)18-32)27(33)24-13-23(22-7-5-4-6-8-22)14-29-26(24)34-25(19)17-30(3)16-21-9-11-28-12-10-21/h7,9-14,19-20,25,32H,4-6,8,15-18H2,1-3H3/t19-,20-,25+/m0/s1 SMILES (mnx) [CH3:1][C@H:19]1[CH2:15][N:31]([C@@H:20]([CH3:2])[CH2:18][OH:32])[C:27](=[O:33])[C:24]2=[C:26]([N:29]=[CH:14][C:23]([C:22]3=[CH:7][CH2:5][CH2:4][CH2:6][CH2:8]3)=[CH:13]2)[O:34][C@@H:25]1[CH2:17][N:30]([CH3:3])[CH2:16][C:21]1=[CH:10][CH:12]=[N:28][CH:11]=[CH:9]1

Parent-child relations graph

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