Water → HCID 178501745, compound
Reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:1][N+:2]1([O-:3])[CH2:4][CH2:6][O:5][CH2:7][CH2:8]1.[CH3:9][c:10]1[c:11]([C:21](=[O:22])[NH:23][c:24]2[cH:25][cH:26][c:27](-[c:30]3[cH:31][cH:32][c:33]([S:36](=[O:37])(=[O:38])[NH:39][CH:40]([CH:41]([CH3:42])[CH3:43])[C:44](=[O:45])[O:46][CH3:47])[cH:34][cH:35]3)[cH:28][cH:29]2)[o:12][c:13]2[c:14]1[c:15]([CH:19]=[CH2:20])[cH:16][cH:17][cH:18]2.[OH2:48]>>[OH:5][CH2:20][CH:19]([c:15]1[c:14]2[c:10]([CH3:9])[c:11]([C:21](=[O:22])[NH:23][c:24]3[cH:25][cH:26][c:27](-[c:30]4[cH:31][cH:32][c:33]([S:36](=[O:37])(=[O:38])[NH:39][CH:40]([CH:41]([CH3:42])[CH3:43])[C:44](=[O:45])[O:46][CH3:47])[cH:34][cH:35]4)[cH:28][cH:29]3)[o:12][c:13]2[cH:18][cH:17][cH:16]1)[OH:48]Participants
5
Sources & evidence
- ORD record
- ord-51027be1bb414ea7a2ed29bb09a870f4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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