Acetic Acid → HCID 18414182, compound
Reaction equation
[C:19](#[N:20])[c:21]1[cH:22][c:23]2[c:24]([CH:31]3[CH2:32][CH2:33][C:34](=[O:37])[CH2:35][CH2:36]3)[cH:25][n:26]([CH3:30])[c:27]2[cH:28][cH:29]1.[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH3:1][O:2][c:3]1[cH:4][c:5]([N:13]2[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]2)[c:6]2[n:7][cH:8][cH:9][n:10][c:11]2[cH:12]1.[CH3:52][C:53](=[O:54])[OH:55].[Cl:56][CH:57]([Cl:58])[CH3:59].[Na+:51]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([N:13]2[CH2:14][CH2:15][N:16]([CH:34]3[CH2:33][CH2:32][CH:31]([c:24]4[c:23]5[cH:22][c:21]([C:19]#[N:20])[cH:29][cH:28][c:27]5[n:26]([CH3:30])[cH:25]4)[CH2:36][CH2:35]3)[CH2:17][CH2:18]2)[c:6]2[n:7][cH:8][cH:9][n:10][c:11]2[cH:12]1Participants
7
Sources & evidence
- ORD record
- ord-5eb500bfb77441d3a40118d43156a830
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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