Water → HCID 11948186, compound
Reaction equation
[CH2:26]([CH3:27])[O:28][C:29](=[O:30])[c:31]1[cH:32][c:33]2[n:34]([c:35]([NH:39][c:40]3[c:41]([O:49][CH3:50])[cH:42][cH:43][c:44]([C:46](=[O:47])[OH:48])[cH:45]3)[n:36][n:37][cH:38]2)[c:51]1[CH3:52].[CH3:11][CH2:12][N:13]=[C:14]=[N:15][CH2:16][CH2:17][CH2:18][N:19]([CH3:20])[CH3:21].[CH:22]1([NH2:25])[CH2:23][CH2:24]1.[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[OH2:58].[OH:1][n:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[n:9][n:10]1>>[CH:22]1([NH:25][C:46]([c:44]2[cH:43][cH:42][c:41]([O:49][CH3:50])[c:40]([NH:39][c:35]3[n:34]4[c:33]([cH:32][c:31]([C:29]([O:28][CH2:26][CH3:27])=[O:30])[c:51]4[CH3:52])[cH:38][n:37][n:36]3)[cH:45]2)=[O:47])[CH2:23][CH2:24]1Participants
7
Sources & evidence
- ORD record
- ord-93e5e4c96280488689ce5c2a70cea3d4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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