morphine hydrochloride trihydrate

Properties Image MNX_ID MNXM158143 reference chebi:55348 formula C17H26ClNO6 global charge 0 mol weight 375.849 InChIKey XELXKCKNPPSFNN-BJWPBXOKSA-N InChI InChI=1S/C17H19NO3.ClH.3H2O/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;;;;/h2-5,10-11,13,16,19-20H,6-8H2,1H3;1H;3*1H2/t10-,11+,13-,16-,17-;;;;/m0..../s1 SMILES CN1CC[C@]23C4=C5C=CC(O)=C4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5.Cl.O.O.O MNX internals InChI (mnx) InChI=1/C17H19NO3.ClH.3H2O/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;;;;/h2-5,10-11,13,16,19-20H,6-8H2,1H3;1H;3*1H2/t10-,11+,13-,16-,17-;;;;/m0..../s1 SMILES (mnx) [CH3:1][N:18]1[CH2:7][CH2:6][C@@:17]23[C@H:10]4[CH:3]=[CH:5][C@H:13]([OH:20])[C@@H:16]2[O:21][C:15]2=[C:12]([OH:19])[CH:4]=[CH:2][C:9](=[C:14]23)[CH2:8][C@H:11]41.[ClH:22].[OH2:23].[OH2:24].[OH2:25]

Parent-child relations graph

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