Acetone → Prednisolone, 1,2-dihydro-9,11-dedihydro-11-desoxy-, 21-acetate(ester)
Reaction equation
[Br-:46].[CH2:43]([Cl:44])[Cl:45].[CH2:47]([N+:48]([CH2:49][CH2:50][CH2:51][CH3:52])([CH2:53][CH2:54][CH2:55][CH3:56])[CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH3:63].[CH3:39][C:40]([CH3:41])=[O:42].[K+:36].[K+:37].[K+:38].[OH2:64].[OH:1][C:2]1([C:3](=[CH2:4])[O:5][c:6]2[cH:7][cH:8][cH:9][cH:10][cH:11]2)[CH2:12][CH2:13][CH:14]2[CH:15]3[CH2:16][CH2:17][C:18]4=[CH:19][C:20](=[O:30])[CH2:21][CH2:22][C:23]4([CH3:24])[C:25]3=[CH:26][CH2:27][C:28]12[CH3:29].[P:31](=[O:32])([O-:33])([O-:34])[O-:35]>>[OH:1][C:2]1([C:3](=[O:4])[CH2:5][O:32][C:40]([CH3:41])=[O:42])[CH2:12][CH2:13][CH:14]2[CH:15]3[CH2:16][CH2:17][C:18]4=[CH:19][C:20](=[O:30])[CH2:21][CH2:22][C:23]4([CH3:24])[C:25]3=[CH:26][CH2:27][C:28]12[CH3:29]Participants
9
Sources & evidence
- ORD record
- ord-a83497ced8614ba5a291264e1ebc58a8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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