Bromide ion → HCID 57460573, compound
Reaction equation
[Br-:37].[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6](-[n:10]2[c:11]([CH3:36])[n:12][c:13]([CH2:32][CH2:33][CH2:34][CH3:35])[c:14]([CH2:17][c:18]3[cH:19][cH:20][c:21](-[c:24]4[c:25]([C:30]#[N:31])[cH:26][cH:27][cH:28][cH:29]4)[cH:22][cH:23]3)[c:15]2=[O:16])[cH:7][cH:8][cH:9]1.[CH3:38][Mg+:39].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH2:46]>>[C:1]([CH3:2])([OH:3])([c:4]1[cH:5][c:6](-[n:10]2[c:11]([CH3:36])[n:12][c:13]([CH2:32][CH2:33][CH2:34][CH3:35])[c:14]([CH2:17][c:18]3[cH:19][cH:20][c:21](-[c:24]4[c:25]([C:30]#[N:31])[cH:26][cH:27][cH:28][cH:29]4)[cH:22][cH:23]3)[c:15]2=[O:16])[cH:7][cH:8][cH:9]1)[CH3:40]Participants
7
Sources & evidence
- ORD record
- ord-4c22fc6e07494cf28b2abadfde5e56c8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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