Water → HCID 178493291, compound
Reaction equation
[B-:42]([F:43])([F:44])([F:45])[F:46].[C:1](=[O:2])([OH:3])[C:4](=[O:5])[c:6]1[cH:7][nH:8][c:9]2[n+:10]([O-:17])[cH:11][cH:12][c:13]([O:15][CH3:16])[c:14]12.[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[OH2:69].[c:25]1(-[n:31]2[n:32][n:33][n:34][c:35]2[N:36]2[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1.[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[cH:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[C:1](=[O:3])([C:4](=[O:5])[c:6]1[cH:7][nH:8][c:9]2[n+:10]([O-:17])[cH:11][cH:12][c:13]([O:15][CH3:16])[c:14]12)[N:39]1[CH2:38][CH2:37][N:36]([c:35]2[n:31](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[n:32][n:33][n:34]2)[CH2:41][CH2:40]1Participants
8
Sources & evidence
- ORD record
- ord-08b041bb970f469a9759ed524f624826
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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