Acetic Acid → HCID 18444288, compound
Reaction equation
[C:45]([O:46][BH-:47]([O:48][C:49](=[O:50])[CH3:51])[O:52][C:53](=[O:54])[CH3:55])(=[O:56])[CH3:57].[CH2:1]1[O:2][CH2:3][CH2:4][CH2:5]1.[CH3:59][C:60](=[O:61])[OH:62].[CH3:6][O:7][c:8]1[cH:9][c:10](-[c:16]2[cH:17][cH:18][cH:19][c:20]([C:22](=[O:23])[N:24]3[CH2:25][CH2:26][N:27]([c:30]4[cH:31][cH:32][c:33]([NH:36][CH2:37][CH2:38][CH2:39][C:40](=[O:41])[O:42][CH2:43][CH3:44])[cH:34][cH:35]4)[CH2:28][CH2:29]3)[n:21]2)[cH:11][cH:12][c:13]1[O:14][CH3:15].[Na+:58]>>[CH3:1][N:36]([c:33]1[cH:32][cH:31][c:30]([N:27]2[CH2:26][CH2:25][N:24]([C:22]([c:20]3[cH:19][cH:18][cH:17][c:16](-[c:10]4[cH:9][c:8]([O:7][CH3:6])[c:13]([O:14][CH3:15])[cH:12][cH:11]4)[n:21]3)=[O:23])[CH2:29][CH2:28]2)[cH:35][cH:34]1)[CH2:37][CH2:38][CH2:39][C:40](=[O:41])[O:42][CH2:43][CH3:44]Participants
6
Sources & evidence
- ORD record
- ord-6d7af2bf3ea1448bb12b9346a4410b69
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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