(2R,3S)-2-[[(2-fluorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-8-pent-1-ynyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

Properties Image MNX_ID MNXM170727 reference chebi:96263 formula C27H34FN3O3 global charge 0 mol weight 467.585 InChIKey RXPBILAYEMNMFE-RLSLOFABSA-N InChI InChI=1S/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25-/m0/s1 SMILES CCCC#CC1=CC2=C(N=C1)O[C@@H](CN(C)CC1=CC=CC=C1F)[C@@H](C)CN([C@@H](C)CO)C2=O MNX internals InChI (mnx) InChI=1/C27H34FN3O3/c1-5-6-7-10-21-13-23-26(29-14-21)34-25(19(2)15-31(27(23)33)20(3)18-32)17-30(4)16-22-11-8-9-12-24(22)28/h8-9,11-14,19-20,25,32H,5-6,15-18H2,1-4H3/t19-,20-,25-/m0/s1 SMILES (mnx) [CH3:1][CH2:5][CH2:6][C:7]#[C:10][C:21]1=[CH:13][C:23]2=[C:26]([N:29]=[CH:14]1)[O:34][C@@H:25]([CH2:17][N:30]([CH3:4])[CH2:16][C:22]1=[CH:11][CH:8]=[CH:9][CH:12]=[C:24]1[F:28])[C@@H:19]([CH3:2])[CH2:15][N:31]([C@@H:20]([CH3:3])[CH2:18][OH:32])[C:27]2=[O:33]

Parent-child relations graph

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