Acetate → HCID 11548036, compound
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([c:7]([C:15](=[O:16])[c:17]3[cH:18][c:19]([O:27][CH3:28])[c:20]([O:25][CH3:26])[c:21]([O:23][CH3:24])[cH:22]3)[c:8](-[c:10]3[cH:11][n:12][nH:13][cH:14]3)[o:9]2)[cH:29][cH:30]1.[CH3:34][C:35](=[O:36])[O-:37].[CH3:38][O:39][c:40]1[cH:41][cH:42][c:43]([B:46]([OH:47])[OH:48])[cH:44][cH:45]1.[Cl:31][CH2:32][Cl:33].[cH:49]1[cH:50][cH:51][n:52][cH:53][cH:54]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([c:7]([C:15](=[O:16])[c:17]3[cH:18][c:19]([O:27][CH3:28])[c:20]([O:25][CH3:26])[c:21]([O:23][CH3:24])[cH:22]3)[c:8](-[c:10]3[cH:11][n:12](-[c:43]4[cH:42][cH:41][c:40]([O:39][CH3:38])[cH:45][cH:44]4)[n:13][cH:14]3)[o:9]2)[cH:29][cH:30]1Participants
6
Sources & evidence
- ORD record
- ord-bebdbf1ab84c4685b6c05b264fbcbd87
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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