Isobutanol → 2-(hydroxymethyl)-5-[2-[(3-hydroxy-4-phenylphenyl)methylamino]benzimidazol-1-yl]oxolane-3,4-diol
Reaction equation
[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][CH:43]([CH2:44][OH:45])[CH3:46].[Cl:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH:7]1[CH:8]([OH:9])[CH:10]([OH:11])[CH:12]([CH2:14][OH:15])[O:13]1)[cH:16][cH:17][cH:18][cH:19]2.[OH:20][c:21]1[cH:22][c:23]([CH2:24][NH2:25])[cH:26][cH:27][c:28]1-[c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[c:2]1([NH:25][CH2:24][c:23]2[cH:22][c:21]([OH:20])[c:28](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[cH:27][cH:26]2)[n:3][c:4]2[c:5]([n:6]1[CH:7]1[CH:8]([OH:9])[CH:10]([OH:11])[CH:12]([CH2:14][OH:15])[O:13]1)[cH:16][cH:17][cH:18][cH:19]2Participants
5
Sources & evidence
- ORD record
- ord-bee29761caa341269d0568c21057dded
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…