Water → HCID 91519689, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][nH:13][c:14]2[c:15]([O:20][CH2:21][C:22](=[O:23])[OH:24])[cH:16][cH:17][cH:18][c:19]12)[CH3:25].[C:26]([c:27]1[nH:28][cH:29][cH:30][n:31]1)([c:32]1[nH:33][cH:34][cH:35][n:36]1)=[O:37].[CH3:38][S:39](=[O:40])(=[O:41])[NH2:42].[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[N:43]12[CH2:44][CH2:45][CH2:46][N:47]=[C:48]1[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]2.[OH2:59]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][nH:13][c:14]2[c:15]([O:20][CH2:21][C:22](=[O:23])[NH:42][S:39]([CH3:38])(=[O:40])=[O:41])[cH:16][cH:17][cH:18][c:19]12)[CH3:25]Participants
7
Sources & evidence
- ORD record
- ord-989d68dabfc548fe9874b84cfd0bf522
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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