Norfluoxetine glucuronide

Properties Image MNX_ID MNXM158788 reference chebi:186343 formula C22H24F3NO7 global charge 0 mol weight 471.428 InChIKey GXZQMXPRYAFVRG-OJRVOLPLSA-N InChI InChI=1S/C22H24F3NO7/c23-22(24,25)13-6-8-14(9-7-13)32-15(12-4-2-1-3-5-12)10-11-26-20-18(29)16(27)17(28)19(33-20)21(30)31/h1-9,15-20,26-29H,10-11H2,(H,30,31)/t15?,16-,17-,18+,19-,20+/m0/s1 SMILES O=C(O)[C@H]1O[C@@H](NCCC(OC2=CC=C(C(F)(F)F)C=C2)C2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]1O MNX internals InChI (mnx) InChI=1/C22H24F3NO7/c23-22(24,25)13-6-8-14(9-7-13)32-15(12-4-2-1-3-5-12)10-11-26-20-18(29)16(27)17(28)19(33-20)21(30)31/h1-9,15-20,26-29H,10-11H2,(H,30,31)/t15?,16-,17-,18+,19-,20+/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:12]([CH:15]([CH2:10][CH2:11][NH:26][C@H:20]2[C@H:18]([OH:29])[C@@H:16]([OH:27])[C@H:17]([OH:28])[C@@H:19]([C:21](=[O:30])[OH:31])[O:33]2)[O:32][C:14]2=[CH:9][CH:7]=[C:13]([C:22]([F:23])([F:24])[F:25])[CH:6]=[CH:8]2)[CH:5]=[CH:3]1

Parent-child relations graph

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