Bicarbonate Ion → 3-Ketooctanoic acid
Reaction equation
[C:14]([O-:15])([OH:16])=[O:17].[C:6]([CH2:7][CH2:8][CH2:9][CH2:10][CH3:11])(=[O:12])[Cl:13].[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH3:19][CH2:20][O:21][CH2:22][CH3:23].[Na+:18]>>[CH2:1]([C:6]([CH2:7][CH2:8][CH2:9][CH2:10][CH3:11])=[O:12])[C:14]([OH:15])=[O:17]Participants
6
Sources & evidence
- ORD record
- ord-73997dd910ed4794a87bdbe31a811215
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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