Methanol → HCID 25266921, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12](-[c:38]2[cH:39][cH:40][c:41]([C:44]([F:45])([F:46])[F:47])[cH:42][cH:43]2)[cH:13][c:14]([CH:16]2[CH2:17][CH2:18][N:19]([CH:22]([CH2:23][CH2:24][CH:25]([CH3:26])[CH3:27])[c:28]3[cH:29][cH:30][c:31]([C:34]([F:35])([F:36])[F:37])[cH:32][cH:33]3)[CH2:20][CH2:21]2)[cH:15]1)=[O:48].[CH3:51][OH:52].[Na+:50].[OH-:49]>>[O:3]=[C:4]([CH:5]([CH2:6][CH:7]([CH3:8])[CH3:9])[c:10]1[cH:11][c:12](-[c:38]2[cH:39][cH:40][c:41]([C:44]([F:45])([F:46])[F:47])[cH:42][cH:43]2)[cH:13][c:14]([CH:16]2[CH2:17][CH2:18][N:19]([CH:22]([CH2:23][CH2:24][CH:25]([CH3:26])[CH3:27])[c:28]3[cH:29][cH:30][c:31]([C:34]([F:35])([F:36])[F:37])[cH:32][cH:33]3)[CH2:20][CH2:21]2)[cH:15]1)[OH:48]Participants
5
Sources & evidence
- ORD record
- ord-55fec075e0384a8189e860defff6c30d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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