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

Properties Image MNX_ID MNXM171325 reference chebi:103714 formula C21H26FN3O3 global charge 0 mol weight 387.455 InChIKey SHRVDEFCKQVYRH-PJIJBLCYSA-N InChI InChI=1S/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14-,19-/m1/s1 SMILES CNC[C@H]1OC2=C(C=C(C3=CC=CC=C3F)C=N2)C(=O)N([C@H](C)CO)C[C@H]1C MNX internals InChI (mnx) InChI=1/C21H26FN3O3/c1-13-11-25(14(2)12-26)21(27)17-8-15(16-6-4-5-7-18(16)22)9-24-20(17)28-19(13)10-23-3/h4-9,13-14,19,23,26H,10-12H2,1-3H3/t13-,14-,19-/m1/s1 SMILES (mnx) [CH3:1][C@@H:13]1[CH2:11][N:25]([C@H:14]([CH3:2])[CH2:12][OH:26])[C:21](=[O:27])[C:17]2=[C:20]([N:24]=[CH:9][C:15]([C:16]3=[CH:6][CH:4]=[CH:5][CH:7]=[C:18]3[F:22])=[CH:8]2)[O:28][C@@H:19]1[CH2:10][NH:23][CH3:3]

Parent-child relations graph

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