Ethanol → HCID 54090572, compound
Reaction equation
[CH3:41][CH2:42][OH:43].[CH:1]1([O:6][c:7]2[cH:8][c:9]([CH:15]([CH2:16][CH2:17][N:18]3[C:19](=[O:20])[c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]4[C:27]3=[O:28])[C:29]#[C:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1.[NH2:38][NH2:39].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH2:37].[OH2:40]>>[CH:1]1([O:6][c:7]2[cH:8][c:9]([CH:15]([CH2:16][CH2:17][NH2:18])[C:29]#[C:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
6
Sources & evidence
- ORD record
- ord-935492fd7e79476a93fd1b8606672b25
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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