Calcium Cation → 3-Cyclohexyl-1-(5-methyl-1,3-dioxan-5-yl)-2-(1,2,4-triazol-1-yl)-propan-1-ol
Reaction equation
[BH4-:1].[CH3:31][CH2:32][OH:33].[CH:5]1([CH2:11][CH:12]([C:13](=[O:14])[C:15]2([CH3:21])[CH2:16][O:17][CH2:18][O:19][CH2:20]2)[n:22]2[n:23][cH:24][n:25][cH:26]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1.[Ca+2:29].[Cl-:27].[Cl-:28].[ClH:30].[Na+:2].[Na+:4].[OH-:3]>>[CH:5]1([CH2:11][CH:12]([CH:13]([OH:14])[C:15]2([CH3:21])[CH2:16][O:17][CH2:18][O:19][CH2:20]2)[n:22]2[n:23][cH:24][n:25][cH:26]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1Participants
9
Sources & evidence
- ORD record
- ord-6b7707f4b4f24b20baa02d36e660e294
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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