Water → HCID 178456278, compound
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[N:4]1[CH2:5][CH:6]([CH3:58])[N:7]([CH:11]([c:12]2[cH:13][c:14]([O:18][Si:19]([C:20]([CH3:21])([CH3:22])[CH3:23])([CH3:24])[CH3:25])[cH:15][cH:16][cH:17]2)[c:26]2[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][CH:33]([CH2:34][c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[C:41](=[O:42])[NH:43][CH:44]([CH2:45][CH:46]([CH3:47])[CH3:48])[C:49](=[O:50])[O:51][C:52]([CH3:53])([CH3:54])[CH3:55])[cH:56][cH:57]2)[CH2:8][CH:9]1[CH3:10].[CH2:61]([N+:62]([CH2:63][CH3:64])([CH2:65][CH3:66])[CH2:67][CH3:68])[CH3:69].[CH3:70][C:71]#[N:72].[F-:60].[OH2:59]>>[CH2:1]([CH:2]=[CH2:3])[N:4]1[CH2:5][CH:6]([CH3:58])[N:7]([CH:11]([c:12]2[cH:13][c:14]([OH:18])[cH:15][cH:16][cH:17]2)[c:26]2[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][CH:33]([CH2:34][c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[C:41](=[O:42])[NH:43][CH:44]([CH2:45][CH:46]([CH3:47])[CH3:48])[C:49](=[O:50])[O:51][C:52]([CH3:53])([CH3:54])[CH3:55])[cH:56][cH:57]2)[CH2:8][CH:9]1[CH3:10]Participants
6
Sources & evidence
- ORD record
- ord-d340f29f5b16415eb5c1a3c633dd25a3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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