Ethanol → HCID 15105171, compound
Reaction equation
[C:1]12([OH:11])[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[CH3:24][CH2:25][OH:26].[OH2:12].[OH2:35].[OH:27][c:28]1[cH:29][cH:30][cH:31][c:32]([OH:33])[cH:34]1.[c:13]1([CH3:14])[cH:15][cH:16][c:17]([S:18]([OH:19])(=[O:20])=[O:21])[cH:22][cH:23]1>>[C:1]12([c:29]3[c:28]([OH:27])[cH:34][c:32]([OH:33])[cH:31][cH:30]3)[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2Participants
6
Sources & evidence
- ORD record
- ord-7dbf50cc542c4e5d95f6aebbe385aa9f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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