Methane → 3-(3-{4-[3-(beta-D-glucopyranosyloxy)-5-isopropyl-1Hpyrazol-4-ylmethyl]-3-methylphenoxy}propylamino)propionamide
Reaction equation
[C:48].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH2:9][CH2:10][C:11]([NH2:12])=[O:13])[CH2:14][CH2:15][CH2:16][O:17][c:18]1[cH:19][c:20]([CH3:45])[c:21]([CH2:24][c:25]2[c:26]([O:33][CH:34]3[CH:35]([OH:36])[CH:37]([OH:38])[CH:39]([OH:40])[CH:41]([CH2:43][OH:44])[O:42]3)[n:27][nH:28][c:29]2[CH:30]([CH3:31])[CH3:32])[cH:22][cH:23]1.[CH3:46][OH:47].[Pd:49]>>[NH:8]([CH2:9][CH2:10][C:11]([NH2:12])=[O:13])[CH2:14][CH2:15][CH2:16][O:17][c:18]1[cH:19][c:20]([CH3:45])[c:21]([CH2:24][c:25]2[c:26]([O:33][CH:34]3[CH:35]([OH:36])[CH:37]([OH:38])[CH:39]([OH:40])[CH:41]([CH2:43][OH:44])[O:42]3)[n:27][nH:28][c:29]2[CH:30]([CH3:31])[CH3:32])[cH:22][cH:23]1Participants
5
Sources & evidence
- ORD record
- ord-fd32d8f21e994e03a58a114d09f96a73
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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