Water → N-(1-{3-(1-benzyloxycarbonyl-4-piperidyl)propionyl}-1,2,3,4-tetrahydro-3-quinolylcarbonyl]-beta-alanine ethyl ester
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH2:13][CH:14]([CH2:17][CH2:18][C:19](=[O:20])[OH:21])[CH2:15][CH2:16]1.[CH2:29]([O:30][C:31]([Cl:32])=[O:33])[CH:34]([CH3:35])[CH3:36].[CH2:37]([CH3:38])[O:39][C:40]([CH2:41][CH2:42][NH:43][C:44](=[O:45])[CH:46]1[CH2:47][NH:48][c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[CH2:55]1)=[O:56].[CH3:22][N:23]1[CH2:24][CH2:25][O:26][CH2:27][CH2:28]1.[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[O:62]1[CH2:63][CH2:64][CH2:65][CH2:66]1.[OH2:67]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH2:13][CH:14]([CH2:17][CH2:18][C:19](=[O:21])[N:48]2[CH2:47][CH:46]([C:44]([NH:43][CH2:42][CH2:41][C:40]([O:39][CH2:37][CH3:38])=[O:56])=[O:45])[CH2:55][c:54]3[c:49]2[cH:50][cH:51][cH:52][cH:53]3)[CH2:15][CH2:16]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-de7bc7dcca41418a8db017ecb6630be8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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