HCID 18374705, compound → 2-Cyclohexyl-2-[3-[[4-(2-methyl-3-phenylpropyl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]acetic acid
Reaction equation
[CH:17](=[O:18])[CH:19]1[CH2:20][N:21]([CH:30]([C:31](=[O:32])[OH:33])[CH:34]2[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2)[CH2:22][CH:23]1[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[NH:40]1[O:41][N:42]([CH2:43][CH2:44][CH2:45][CH:46]2[CH2:47][CH2:48][N:49]([CH2:50][CH:51]3[CH:52]([c:53]4[cH:54][cH:55][cH:56][cH:57][cH:58]4)[CH2:59][N:60]([CH:61]([CH:62]4[CH2:63][CH2:64][CH2:65][CH2:66][CH2:67]4)[C:68]([OH:69])=[O:70])[CH2:71]3)[CH2:72][CH2:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][c:79]21.[c:1]1([CH2:7][CH:8]([CH2:9][CH:10]2[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[CH3:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH:8]([CH2:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:17][CH:19]3[CH2:20][N:21]([CH:30]([C:31](=[O:32])[OH:33])[CH:34]4[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]4)[CH2:22][CH:23]3[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:14][CH2:15]2)[CH3:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
4
Sources & evidence
- ORD record
- ord-e3fb2a353b0246048781b68fdd000b56
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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