Calcium Cation → 2-(1,3-Dihydroisoindol-2-yl)-1-(1,4-dioxaspiro[4.5]dec-8-yl)ethanol
Reaction equation
[CH2:14]1[NH:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]21.[CH3:40][C:41]#[N:42].[Ca+2:31].[F:23][C:24]([F:25])([F:26])[S:27]([O-:28])(=[O:29])=[O:30].[F:32][C:33]([F:34])([F:35])[S:36]([O-:37])(=[O:38])=[O:39].[O:1]1[CH:2]([CH:4]2[CH2:5][CH2:6][C:7]3([O:8][CH2:9][CH2:10][O:11]3)[CH2:12][CH2:13]2)[CH2:3]1>>[OH:1][CH:2]([CH2:3][N:15]1[CH2:14][c:22]2[c:17]([cH:18][cH:19][cH:20][cH:21]2)[CH2:16]1)[CH:4]1[CH2:5][CH2:6][C:7]2([O:8][CH2:9][CH2:10][O:11]2)[CH2:12][CH2:13]1Participants
6
Sources & evidence
- ORD record
- ord-819f3d114de8422d967a7af17567244e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…