(2S,3R)-8-(dimethylamino)-2-[(dimethylamino)methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-1,5-benzoxazocin-6-one

Properties Image MNX_ID MNXM171331 reference chebi:124333 formula C19H31N3O3 global charge 0 mol weight 349.475 InChIKey WTLSFXRNHZPOMH-HBUWYVDXSA-N InChI InChI=1S/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18-/m1/s1 SMILES C[C@@H]1CN([C@H](C)CO)C(=O)C2=C(C=CC(N(C)C)=C2)O[C@@H]1CN(C)C MNX internals InChI (mnx) InChI=1/C19H31N3O3/c1-13-10-22(14(2)12-23)19(24)16-9-15(21(5)6)7-8-17(16)25-18(13)11-20(3)4/h7-9,13-14,18,23H,10-12H2,1-6H3/t13-,14-,18-/m1/s1 SMILES (mnx) [CH3:1][C@@H:13]1[CH2:10][N:22]([C@H:14]([CH3:2])[CH2:12][OH:23])[C:19](=[O:24])[C:16]2=[C:17]([CH:8]=[CH:7][C:15]([N:21]([CH3:5])[CH3:6])=[CH:9]2)[O:25][C@@H:18]1[CH2:11][N:20]([CH3:3])[CH3:4]

Parent-child relations graph

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