Acetone → 2-Methylthio-5-(6-carboxyhexylidene)-4-(3-hydroxy-1-octenyl)-2-cyclopentenone
Reaction equation
[CH3:1][S:2][C:3]1=[CH:7][CH:6]([CH:8]=[CH:9][CH:10]([CH2:11][CH2:12][CH2:13][CH2:14][CH3:15])[OH:16])[C:5](=[CH:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][C:23](=[O:24])[O:25][CH3:26])[C:4]1=[O:27].[CH3:41][C:42](=[O:43])[CH3:44].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[ClH:33].[NH4+:34].[NH4+:35].[O-:28][P:29](=[O:30])([O-:31])[O-:32].[O-:36][S:37](=[O:38])(=[O:39])[O-:40]>>[CH3:1][S:2][C:3]1=[CH:7][CH:6]([CH:8]=[CH:9][CH:10]([CH2:11][CH2:12][CH2:13][CH2:14][CH3:15])[OH:16])[C:5](=[CH:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][C:23](=[O:24])[OH:25])[C:4]1=[O:27]Participants
8
Sources & evidence
- ORD record
- ord-d993f8f38cc24850900a2d8bd2ed4b0b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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