Methanol → HCID 178495189, compound
Reaction equation
[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:1][O:2][C:3]([C:4]([CH2:5][CH:6]1[N:7]([S:43](=[O:44])(=[O:45])[c:46]2[cH:47][cH:48][c:49]([CH3:52])[cH:50][cH:51]2)[CH2:8][CH:9]([O:26][CH2:27][c:28]2[cH:29][cH:30][c:31]3[c:32]([cH:42]2)[N:33]([CH2:37][CH2:38][CH2:39][O:40][CH3:41])[CH2:34][CH2:35][O:36]3)[CH:10]([c:12]2[cH:13][cH:14][c:15]([CH2:18][O:19][CH2:20][CH:21]([CH2:22][O:23][CH3:24])[CH3:25])[cH:16][cH:17]2)[CH2:11]1)([CH3:53])[CH3:54])=[O:55].[CH3:63][OH:64].[Li+:56].[OH-:57]>>[O:2]=[C:3]([C:4]([CH2:5][CH:6]1[N:7]([S:43](=[O:44])(=[O:45])[c:46]2[cH:47][cH:48][c:49]([CH3:52])[cH:50][cH:51]2)[CH2:8][CH:9]([O:26][CH2:27][c:28]2[cH:29][cH:30][c:31]3[c:32]([cH:42]2)[N:33]([CH2:37][CH2:38][CH2:39][O:40][CH3:41])[CH2:34][CH2:35][O:36]3)[CH:10]([c:12]2[cH:13][cH:14][c:15]([CH2:18][O:19][CH2:20][CH:21]([CH2:22][O:23][CH3:24])[CH3:25])[cH:16][cH:17]2)[CH2:11]1)([CH3:53])[CH3:54])[OH:55]Participants
6
Sources & evidence
- ORD record
- ord-7109b60730f14ea1ba4eafe9775800ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…