Hydrochloric Acid → methyl 2-[[2-[(3,5-dimethylbenzoyl)-methylamino]-3-[4-(1,2-oxazol-5-yl)phenyl]propanoyl]amino]-3-(1H-indol-3-yl)propanoate
Reaction equation
[CH3:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[N:7]([CH:8]([CH2:9][c:10]2[cH:11][cH:12][c:13](-[c:16]3[cH:17][cH:18][n:19][o:20]3)[cH:14][cH:15]2)[C:21](=[O:22])[OH:23])[CH3:24])[cH:25][c:26]([CH3:28])[cH:27]1.[CH3:30][O:31][C:32]([CH:33]([NH2:34])[CH2:35][c:36]1[cH:37][nH:38][c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]12)=[O:45].[CH3:56][N:57]([CH3:58])[CH2:59][CH2:60][CH2:61][N:62]=[C:63]=[N:64][CH2:65][CH3:66].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[ClH:29].[OH:46][c:47]1[c:48]2[n:49][n:50][nH:51][c:52]2[cH:53][cH:54][cH:55]1>>[CH3:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[N:7]([CH:8]([CH2:9][c:10]2[cH:11][cH:12][c:13](-[c:16]3[cH:17][cH:18][n:19][o:20]3)[cH:14][cH:15]2)[C:21](=[O:23])[NH:34][CH:33]([C:32]([O:31][CH3:30])=[O:45])[CH2:35][c:36]2[cH:37][nH:38][c:39]3[cH:40][cH:41][cH:42][cH:43][c:44]23)[CH3:24])[cH:25][c:26]([CH3:28])[cH:27]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-1984c244dcd14be08a1e5c3d3e30b322
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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