Methanol → HCID 178513924, compound
Reaction equation
[CH2:42]([c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)[N:49]=[C:50]=[O:51].[CH2:54]([Cl:55])[Cl:56].[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:52][OH:53].[OH:1][CH:2]([CH2:3][N:4]([NH2:5])[CH2:6][CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1)[CH:13]([CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[NH:21][C:22]([CH:23]([NH:24][C:25](=[O:26])[c:27]1[n:28][c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[cH:35][cH:36]1)[CH2:37][C:38]([NH2:39])=[O:40])=[O:41]>>[OH:1][CH:2]([CH2:3][N:4]([NH:5][C:50]([NH:49][CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)=[O:51])[CH2:6][CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1)[CH:13]([CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[NH:21][C:22]([CH:23]([NH:24][C:25](=[O:26])[c:27]1[n:28][c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[cH:35][cH:36]1)[CH2:37][C:38]([NH2:39])=[O:40])=[O:41]Participants
6
Sources & evidence
- ORD record
- ord-7452aacf4844473aae5968ea94addb90
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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