N-[6-(3,3-dimethylbutylamino)-3-hydroxy-5-methyl-6-oxo-1-phenylhexan-2-yl]-3-methylsulfonylbenzamide → N-[6-(2-bicyclo[2.2.1]heptanylamino)-3-hydroxy-5-methyl-6-oxo-1-phenylhexan-2-yl]-3-methoxy-5-methylsulfonylbenzamide
Reaction equation
[CH2:1]([CH:2]([NH:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][cH:9][c:10]([S:11]([CH3:12])(=[O:13])=[O:14])[cH:15]1)[CH:16]([OH:17])[CH2:18][CH:19]([C:20](=[O:21])[NH:22][CH2:23][CH2:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH3:29])[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH3:36][O:37][c:38]1[cH:39][c:40]([C:41](=[O:42])[OH:43])[cH:44][c:45]([S:47](=[O:48])(=[O:49])[CH3:50])[cH:46]1.[CH:51]12[CH:52]([NH:58][C:59]([CH:60]([CH2:61][CH:62]([CH:63]([CH2:64][c:65]3[cH:66][cH:67][cH:68][cH:69][cH:70]3)[NH2:71])[OH:72])[CH3:73])=[O:74])[CH2:53][CH:54]([CH2:55][CH2:56]1)[CH2:57]2>>[CH3:36][O:37][c:38]1[cH:39][c:40]([C:41](=[O:43])[NH:71][CH:63]([CH:62]([CH2:61][CH:60]([C:59]([NH:58][CH:52]2[CH:51]3[CH2:56][CH2:55][CH:54]([CH2:53]2)[CH2:57]3)=[O:74])[CH3:73])[OH:72])[CH2:64][c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:44][c:45]([S:47](=[O:48])(=[O:49])[CH3:50])[cH:46]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-53ed6adedcf04cdf9b191d5edf93de9d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…