Acetate → 17-Hydroxy-3,20-dioxopregn-4-en-21-yl acetate
Reaction equation
[CH3:27][C:28]([O-:29])=[O:30].[CH3:32][N:33]([CH3:34])[CH:35]=[O:36].[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[Cl:1][CH2:2][C:3]([C:4]1([OH:24])[CH2:5][CH2:6][CH:7]2[CH:8]3[CH2:9][CH2:10][C:11]4=[CH:12][C:13](=[O:23])[CH2:14][CH2:15][C:16]4([CH3:17])[CH:18]3[CH2:19][CH2:20][C:21]12[CH3:22])=[O:25].[K+:26].[OH2:31]>>[CH2:2]([C:3]([C:4]1([OH:24])[CH2:5][CH2:6][CH:7]2[CH:8]3[CH2:9][CH2:10][C:11]4=[CH:12][C:13](=[O:23])[CH2:14][CH2:15][C:16]4([CH3:17])[CH:18]3[CH2:19][CH2:20][C:21]12[CH3:22])=[O:25])[O:30][C:28]([CH3:27])=[O:29]Participants
7
Sources & evidence
- ORD record
- ord-beb8b1785ef2416bbef25e567e42eb8a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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