Acetic Acid → HCID 87999420, compound
Reaction equation
[C:47]([BH3-:48])#[N:49].[CH2:35]([CH3:36])[O:37][C:38](=[O:39])[CH:40]1[CH2:41][CH2:42][C:43](=[O:46])[CH2:44][CH2:45]1.[CH3:31][C:32](=[O:33])[OH:34].[CH3:51][OH:52].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][O:7][CH2:8][CH:9]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[N:16]2[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]2)[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)([F:29])[F:30].[Na+:50]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][O:7][CH2:8][CH:9]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[N:16]2[CH2:17][CH2:18][N:19]([CH:43]3[CH2:42][CH2:41][CH:40]([C:38]([O:37][CH2:35][CH3:36])=[O:39])[CH2:45][CH2:44]3)[CH2:20][CH2:21]2)[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)([F:29])[F:30]Participants
7
Sources & evidence
- ORD record
- ord-b4d23bbfabfc4cf581537a73cf7ad75a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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