Ethanol → HCID 43435894, compound
Reaction equation
[BH4-:23].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:1][n:2]1[n:3][cH:4][c:5]([C:8]([CH3:9])=[O:10])[c:6]1[CH3:7].[CH3:20][CH2:21][OH:22].[CH3:25][CH:26]([CH3:27])[O-:28].[CH3:29][CH:30]([CH3:31])[O-:32].[CH3:33][CH:34]([CH3:35])[O-:36].[CH3:37][CH:38]([CH3:39])[O-:40].[Na+:24].[Ti+4:41].[c:11]1([CH:17]([CH3:18])[NH2:19])[cH:12][cH:13][cH:14][cH:15][cH:16]1>>[CH3:1][n:2]1[n:3][cH:4][c:5]([CH:8]([CH3:9])[NH:19][CH:17]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[CH3:18])[c:6]1[CH3:7]Participants
9
Sources & evidence
- ORD record
- ord-8907a6281107467db941bece55338396
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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