dihydrocodeine

Properties Image MNX_ID MNXM727525 reference chebi:135276 formula C18H23NO3 global charge 0 mol weight 301.386 InChIKey RBOXVHNMENFORY-DNJOTXNNSA-N InChI InChI=1S/C18H23NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-13,17,20H,4-5,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1 SMILES COC1=CC=C2C[C@@H]3[C@@H]4CC[C@H](O)[C@@H]5OC1=C2[C@]45CCN3C MNX internals InChI (mnx) InChI=1/C18H23NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-13,17,20H,4-5,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1 SMILES (mnx) [CH3:1][N:19]1[CH2:8][CH2:7][C@@:18]23[C@H:11]4[CH2:4][CH2:5][C@H:13]([OH:20])[C@@H:17]2[O:22][C:16]2=[C:14]([O:21][CH3:2])[CH:6]=[CH:3][C:10](=[C:15]23)[CH2:9][C@H:12]41

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0