Water → HCID 69059895, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]([CH3:9])([CH3:10])[c:11]1[cH:12][c:13]([CH2:17][CH:18]([CH3:19])[NH2:20])[cH:14][cH:15][cH:16]1)=[O:21].[CH3:22][S:23](=[O:24])(=[O:25])[c:26]1[n:27][cH:28][cH:29][c:30]([N:32]2[C:33]3=[N:42][C:41]([c:43]4[cH:44][cH:45][cH:46][cH:47][cH:48]4)=[CH:40][CH2:39][N:34]3[C:35](=[O:38])[CH2:36][CH2:37]2)[n:31]1.[CH3:50][N:51]1[CH2:52][CH2:53][CH2:54][C:55]1=[O:56].[OH2:49]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]([CH3:9])([CH3:10])[c:11]1[cH:12][c:13]([CH2:17][CH:18]([CH3:19])[NH:20][c:26]2[n:27][cH:28][cH:29][c:30]([N:32]3[C:33]4=[N:42][C:41]([c:43]5[cH:44][cH:45][cH:46][cH:47][cH:48]5)=[CH:40][CH2:39][N:34]4[C:35](=[O:38])[CH2:36][CH2:37]3)[n:31]2)[cH:14][cH:15][cH:16]1)=[O:21]Participants
5
Sources & evidence
- ORD record
- ord-c09367116a1a4e0b8d60824722f10d3c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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