Water → HCID 57387081, compound
Reaction equation
[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[CH:1]1([C:4](=[O:5])[NH:6][c:7]2[s:8][c:9]3[n:10][c:11]([O:16][c:17]4[cH:18][c:19]([C:20]([OH:21])=[O:22])[cH:23][cH:24][cH:25]4)[cH:12][cH:13][c:14]3[n:15]2)[CH2:2][CH2:3]1.[OH2:55].[c:26]1([P:27]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)(=[O:36])[N:40]=[N+:28]=[N-:29])[cH:37][cH:38][cH:39][cH:41][cH:42]1>>[CH:1]1([C:4](=[O:5])[NH:6][c:7]2[s:8][c:9]3[n:10][c:11]([O:16][c:17]4[cH:18][c:19]([NH2:40])[cH:23][cH:24][cH:25]4)[cH:12][cH:13][c:14]3[n:15]2)[CH2:2][CH2:3]1Participants
6
Sources & evidence
- ORD record
- ord-bb7c3c9ab535429faa21c097dd5a2610
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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