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

Properties Image MNX_ID MNXM170391 reference chebi:96328 formula C27H34FN3O4 global charge 0 mol weight 483.584 InChIKey HVXCQDGXUZNQFT-IMWIBFENSA-N InChI InChI=1S/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24+/m1/s1 SMILES C[C@@H]1CN([C@@H](C)CO)C(=O)C2=C(N=CC(C#CC(C)(C)O)=C2)O[C@H]1CN(C)CC1=CC(F)=CC=C1 MNX internals InChI (mnx) InChI=1/C27H34FN3O4/c1-18-14-31(19(2)17-32)26(33)23-12-20(9-10-27(3,4)34)13-29-25(23)35-24(18)16-30(5)15-21-7-6-8-22(28)11-21/h6-8,11-13,18-19,24,32,34H,14-17H2,1-5H3/t18-,19+,24+/m1/s1 SMILES (mnx) [CH3:1][C@@H:18]1[CH2:14][N:31]([C@@H:19]([CH3:2])[CH2:17][OH:32])[C:26](=[O:33])[C:23]2=[C:25]([N:29]=[CH:13][C:20]([C:9]#[C:10][C:27]([CH3:3])([CH3:4])[OH:34])=[CH:12]2)[O:35][C@H:24]1[CH2:16][N:30]([CH3:5])[CH2:15][C:21]1=[CH:11][C:22]([F:28])=[CH:8][CH:6]=[CH:7]1

Parent-child relations graph

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