Ethanol → HCID 73742889, compound
Reaction equation
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:1][O:2][C:3]([CH2:4][O:5][c:6]1[c:7]([CH3:43])[cH:8][c:9]([O:12][CH2:13][CH:14]=[CH:15][C:16]#[C:17][c:18]2[cH:19][cH:20][c:21]([C:24]#[C:25][CH:26]=[CH:27][CH2:28][O:29][c:30]3[cH:31][c:32]([CH3:42])[c:33]([O:36][CH2:37][C:38](=[O:39])[O:40][CH3:41])[cH:34][cH:35]3)[cH:22][cH:23]2)[cH:10][cH:11]1)=[O:44].[CH3:48][CH2:49][OH:50].[Na+:46].[OH-:45].[OH2:47]>>[CH3:1][O:2][C:3]([CH2:4][O:5][c:6]1[c:7]([CH3:43])[cH:8][c:9]([O:12][CH2:13][CH:14]=[CH:15][C:16]#[C:17][c:18]2[cH:19][cH:20][c:21]([C:24]#[C:25][CH:26]=[CH:27][CH2:28][O:29][c:30]3[cH:31][c:32]([CH3:42])[c:33]([O:36][CH2:37][C:38](=[O:39])[OH:40])[cH:34][cH:35]3)[cH:22][cH:23]2)[cH:10][cH:11]1)=[O:44]Participants
7
Sources & evidence
- ORD record
- ord-97dc0ee0e51c450e80f5a1756b769e61
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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