Ethanol → HCID 67273164, compound
Reaction equation
[CH3:55][CH2:56][OH:57].[CH3:58][OH:59].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:51][cH:52][cH:53][cH:54]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([C:19](=[O:20])[N:21]2[CH2:22][CH2:23][CH:24]([N:27]3[CH2:28][CH2:29][N:30]([CH2:33][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:31][CH2:32]3)[CH2:25][CH2:26]2)[CH2:40][c:41]2[cH:42][c:43]([O:49][CH3:50])[c:44]([OH:48])[c:45]([CH3:47])[cH:46]2)[CH2:13][CH2:14]1>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:51][cH:52][cH:53][cH:54]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([C:19](=[O:20])[N:21]2[CH2:22][CH2:23][CH:24]([N:27]3[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]3)[CH2:25][CH2:26]2)[CH2:40][c:41]2[cH:42][c:43]([O:49][CH3:50])[c:44]([OH:48])[c:45]([CH3:47])[cH:46]2)[CH2:13][CH2:14]1Participants
4
Sources & evidence
- ORD record
- ord-9a5881f8369440428ad9dab8b0ca268e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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