Acetic Acid → 2,2-Dimethyl-5-[1-(4-o-tolylmethanesulfinyl-phenyl)-but-2-ynyl]-[1,3]dioxane-4,6-dione
Reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[CH3:3][C:4]1([CH3:31])[O:5][C:6](=[O:30])[CH:7]([CH:11]([C:12]#[C:13][CH3:14])[c:15]2[cH:16][cH:17][c:18]([S:21][CH2:22][c:23]3[c:24]([CH3:29])[cH:25][cH:26][cH:27][cH:28]3)[cH:19][cH:20]2)[C:8](=[O:10])[O:9]1.[ClH:33].[OH2:32].[OH:1][OH:2]>>[O:1]=[S:21]([c:18]1[cH:17][cH:16][c:15]([CH:11]([CH:7]2[C:6](=[O:30])[O:5][C:4]([CH3:3])([CH3:31])[O:9][C:8]2=[O:10])[C:12]#[C:13][CH3:14])[cH:20][cH:19]1)[CH2:22][c:23]1[c:24]([CH3:29])[cH:25][cH:26][cH:27][cH:28]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-b3d051adba5042b6976672e285abf8e3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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