Acetate → HCID 69230925, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][c:9]1[c:10]([CH2:31][NH:32][C:33](=[O:34])[O:35][CH:36]([CH3:37])[CH3:38])[cH:11][c:12]([O:15][CH2:16][CH2:17][c:18]2[n:19][c:20](-[c:24]3[cH:25][cH:26][c:27]([Br:30])[cH:28][cH:29]3)[o:21][c:22]2[CH3:23])[cH:13][cH:14]1)=[O:39].[C:78]([O-:79])(=[O:80])[CH3:81].[C:83]([O-:84])(=[O:85])[CH3:86].[CH2:74]([OH:75])[CH2:76][CH3:77].[Na+:68].[Na+:69].[O-:70][C:71](=[O:72])[O-:73].[Pd+2:82].[c:49]1([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[cH:63][cH:64][cH:65][cH:66][cH:67]1.[n:40]1[cH:41][c:42]([B:46]([OH:47])[OH:48])[cH:43][cH:44][cH:45]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][c:9]1[c:10]([CH2:31][NH:32][C:33](=[O:34])[O:35][CH:36]([CH3:37])[CH3:38])[cH:11][c:12]([O:15][CH2:16][CH2:17][c:18]2[n:19][c:20](-[c:24]3[cH:25][cH:26][c:27](-[c:42]4[cH:41][n:40][cH:45][cH:44][cH:43]4)[cH:28][cH:29]3)[o:21][c:22]2[CH3:23])[cH:13][cH:14]1)=[O:39]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-2704e4148b144231b48970202a8a0b6e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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