Water → HCID 178502225, compound
Reaction equation
[CH3:38][O:39][C:40](=[O:41])[NH:42][CH:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[C:48](=[O:49])[OH:50].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[OH2:51].[s:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([CH2:12][N:13]([CH2:14][CH:15]([CH:16]([CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[NH:24][C:25]([CH:26]([NH:27][C:28](=[O:29])[O:30][CH3:31])[CH:32]([CH3:33])[CH3:34])=[O:35])[OH:36])[NH2:37])[cH:10][cH:11]2)[n:3][cH:4][cH:5]1>>[s:1]1[c:2](-[c:6]2[cH:7][cH:8][c:9]([CH2:12][N:13]([CH2:14][CH:15]([CH:16]([CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[NH:24][C:25]([CH:26]([NH:27][C:28](=[O:29])[O:30][CH3:31])[CH:32]([CH3:33])[CH3:34])=[O:35])[OH:36])[NH:37][C:48]([CH:43]([NH:42][C:40]([O:39][CH3:38])=[O:41])[C:44]([CH3:45])([CH3:46])[CH3:47])=[O:49])[cH:10][cH:11]2)[n:3][cH:4][cH:5]1Participants
6
Sources & evidence
- ORD record
- ord-cd1c0fb2e7454b62b4e94b80cda94a0f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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