Acetaldehyde → HCID 59135843, compound
Reaction equation
[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[s:7][cH:8][cH:9][cH:10]1)[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][c:17]([C:20]3=[N:24][CH2:23][C:22]4([S:21]3)[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]4)[nH:18][c:19]12.[CH:30]([CH3:31])=[O:32].[Na+:46].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:47]>>[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[s:7][cH:8][cH:9][cH:10]1)[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][c:17]([C:20]3=[N:24][CH2:23][C:22]4([S:21]3)[CH2:25][CH2:26][N:27]([CH2:30][CH3:31])[CH2:28][CH2:29]4)[nH:18][c:19]12Participants
7
Sources & evidence
- ORD record
- ord-3113e9d7fd64469ca1b53a6e9b0e0782
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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