Ethanol → HCID 23000304, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]1[n:10][n:11][c:12]2[n:13]1[n:14][c:15]([NH:18][CH2:19][CH2:20][CH2:21][N:22]1[CH2:23][CH2:24][CH:25]([O:28][CH:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[CH2:26][CH2:27]1)[cH:16][cH:17]2)=[O:42].[CH3:45][CH2:46][OH:47].[Na+:44].[OH-:43]>>[O:3]=[C:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]1[n:10][n:11][c:12]2[n:13]1[n:14][c:15]([NH:18][CH2:19][CH2:20][CH2:21][N:22]1[CH2:23][CH2:24][CH:25]([O:28][CH:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[CH2:26][CH2:27]1)[cH:16][cH:17]2)[OH:42]Participants
5
Sources & evidence
- ORD record
- ord-90d1c3fd795f4b1da94c04e9e671983d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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