Methanol → HCID 66744596, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[n:10][cH:11][c:12]([CH:36]2[CH:37]([C:39](=[O:40])[O:41][CH2:42][CH3:43])[CH2:38]2)[n:13][c:14]1-[c:15]1[o:16][c:17](-[c:20]2[cH:21][cH:22][c:23]([CH2:26][N:27]([CH3:28])[C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[cH:24][cH:25]2)[n:18][n:19]1)[C:44](=[O:45])[O:46][C:47]([CH3:48])([CH3:49])[CH3:50].[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:58][OH:59].[CH3:60][CH2:61][O:62][C:63]([CH3:64])=[O:65].[Na+:52].[OH-:51]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([c:9]1[n:10][cH:11][c:12]([CH:36]2[CH:37]([C:39](=[O:40])[OH:41])[CH2:38]2)[n:13][c:14]1-[c:15]1[o:16][c:17](-[c:20]2[cH:21][cH:22][c:23]([CH2:26][N:27]([CH3:28])[C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[cH:24][cH:25]2)[n:18][n:19]1)[C:44](=[O:45])[O:46][C:47]([CH3:48])([CH3:49])[CH3:50]Participants
7
Sources & evidence
- ORD record
- ord-a73481b6694a4d7bb8ac2256bbbe2a3d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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