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

Properties Image MNX_ID MNXM171306 reference chebi:114118 formula C27H35N3O4 global charge 0 mol weight 465.594 InChIKey CXNSNJNJSOSVDN-OHUGHZGNSA-N InChI InChI=1S/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20+,25-/m1/s1 SMILES CCCN(C)C[C@H]1OC2=C(C=C(C#CC3=CC=CC=C3OC)C=N2)C(=O)N([C@@H](C)CO)C[C@H]1C MNX internals InChI (mnx) InChI=1/C27H35N3O4/c1-6-13-29(4)17-25-19(2)16-30(20(3)18-31)27(32)23-14-21(15-28-26(23)34-25)11-12-22-9-7-8-10-24(22)33-5/h7-10,14-15,19-20,25,31H,6,13,16-18H2,1-5H3/t19-,20+,25-/m1/s1 SMILES (mnx) [CH3:1][CH2:6][CH2:13][N:29]([CH3:4])[CH2:17][C@@H:25]1[C@H:19]([CH3:2])[CH2:16][N:30]([C@@H:20]([CH3:3])[CH2:18][OH:31])[C:27](=[O:32])[C:23]2=[C:26]([N:28]=[CH:15][C:21]([C:11]#[C:12][C:22]3=[CH:9][CH:7]=[CH:8][CH:10]=[C:24]3[O:33][CH3:5])=[CH:14]2)[O:34]1

Parent-child relations graph

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