Ethanol → HCID 67055953, compound
Reaction equation
[C:40](=[O:41])([O:42][C:43]([CH3:44])([CH3:45])[CH3:46])[NH:47][CH:48]1[CH2:49][CH2:50][NH:51][CH2:52][CH2:53]1.[CH3:54][CH2:55][OH:56].[c:1]1(-[c:7]2[c:8]3[c:9]([NH:32][CH2:33][c:34]4[n:35][cH:36][cH:37][cH:38][cH:39]4)[n:10][c:11](-[c:17]4[cH:18][c:19](-[c:23]5[n:24][o:25][c:26]([C:28](=[O:29])[O:30][CH3:31])[n:27]5)[cH:20][n:21][cH:22]4)[n:12][c:13]3[cH:14][cH:15][cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[c:8]3[c:9]([NH:32][CH2:33][c:34]4[n:35][cH:36][cH:37][cH:38][cH:39]4)[n:10][c:11](-[c:17]4[cH:18][c:19](-[c:23]5[n:24][o:25][c:26]([C:28](=[O:29])[N:51]6[CH2:50][CH2:49][CH:48]([NH:47][C:40](=[O:41])[O:42][C:43]([CH3:44])([CH3:45])[CH3:46])[CH2:53][CH2:52]6)[n:27]5)[cH:20][n:21][cH:22]4)[n:12][c:13]3[cH:14][cH:15][cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-716194f8ee954663b8650b0f5eaab407
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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