beta-oxymorphol

Properties Image MNX_ID MNXM152778 reference chebi:174903 formula C17H21NO4 global charge 0 mol weight 303.358 InChIKey AABLHGPVOULICI-LQPBRMSDSA-N InChI InChI=1S/C17H21NO4/c1-18-7-6-16-13-9-2-3-10(19)14(13)22-15(16)11(20)4-5-17(16,21)12(18)8-9/h2-3,11-12,15,19-21H,4-8H2,1H3/t11-,12-,15+,16+,17-/m1/s1 SMILES CN1CC[C@]23C4=C5C=CC(O)=C4O[C@H]2[C@H](O)CC[C@@]3(O)[C@H]1C5 MNX internals InChI (mnx) InChI=1/C17H21NO4/c1-18-7-6-16-13-9-2-3-10(19)14(13)22-15(16)11(20)4-5-17(16,21)12(18)8-9/h2-3,11-12,15,19-21H,4-8H2,1H3/t11-,12-,15+,16+,17-/m1/s1 SMILES (mnx) [CH3:1][N:18]1[CH2:7][CH2:6][C@:16]23[C:13]4=[C:9]5[CH:2]=[CH:3][C:10]([OH:19])=[C:14]4[O:22][C@H:15]2[C@H:11]([OH:20])[CH2:4][CH2:5][C@@:17]3([OH:21])[C@H:12]1[CH2:8]5

Parent-child relations graph

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