Ethanol → (2RS,3RS)-2-[3-(1,1-difluoroethyl)benzyl]-3-(4-fluorophenyl)-3-hydroxypropionic acid
Reaction equation
[CH2:29]([OH:30])[CH3:31].[F:1][C:2]([CH3:3])([F:4])[c:5]1[cH:6][c:7]([CH2:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH:15]([OH:16])[c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)[cH:24][cH:25][cH:26]1.[Na+:28].[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1.[OH-:27]>>[F:1][C:2]([CH3:3])([F:4])[c:5]1[cH:6][c:7]([CH2:8][CH:9]([C:10](=[O:11])[OH:12])[CH:15]([OH:16])[c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)[cH:24][cH:25][cH:26]1Participants
6
Sources & evidence
- ORD record
- ord-061edd8a64bf4b039dbbfbf656bbdb62
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…