Ethanol → HCID 67315062, compound
Reaction equation
[C:22](#[N:23])[c:24]1[cH:25][cH:26][c:27]([CH:28]=[O:29])[cH:30][cH:31]1.[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[C:46](=[O:47])([OH:48])[O-:49].[CH2:1]([CH2:2][CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][NH:9][CH2:10][c:11]1[cH:12][cH:13][c:14]([C:15]#[N:16])[cH:17][cH:18]1)[CH2:19][CH2:20][CH3:21].[CH3:51][CH2:52][OH:53].[Na+:45].[Na+:50]>>[CH2:1]([CH2:2][CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][N:9]([CH2:10][c:11]1[cH:12][cH:13][c:14]([C:15]#[N:16])[cH:17][cH:18]1)[CH2:28][c:27]1[cH:26][cH:25][c:24]([C:22]#[N:23])[cH:31][cH:30]1)[CH2:19][CH2:20][CH3:21]Participants
7
Sources & evidence
- ORD record
- ord-f87486cf643a4d9b93a28cd51e8a3a59
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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