Ethanol → HCID 17757392, compound
Reaction equation
[CH3:44][CH2:45][OH:46].[CH:1]1([N:7]2[CH2:8][CH2:9][C:10]3([CH2:11][CH2:12][N:13]([CH2:15][c:16]4[cH:17][cH:18][c:19]([CH2:20][N:21]([CH2:22][c:23]5[nH:24][cH:25][cH:26][n:27]5)[CH2:28][c:29]5[n:30]([CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[cH:31][cH:32][n:33]5)[cH:40][cH:41]4)[CH2:14]3)[CH2:42][CH2:43]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([N:7]2[CH2:8][CH2:9][C:10]3([CH2:11][CH2:12][N:13]([CH2:15][c:16]4[cH:17][cH:18][c:19]([CH2:20][N:21]([CH2:22][c:23]5[nH:24][cH:25][cH:26][n:27]5)[CH2:28][c:29]5[n:30]([CH2:34][C:35](=[O:36])[OH:37])[cH:31][cH:32][n:33]5)[cH:40][cH:41]4)[CH2:14]3)[CH2:42][CH2:43]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
3
Sources & evidence
- ORD record
- ord-e85c4be47d684ab0b891a3d753ad4475
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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