Hydrochloric Acid → HCID 68541670, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11]([NH:12][c:13]2[c:14]([F:37])[cH:15][c:16](-[c:19]3[cH:20][n:21][c:22]4[n:23]3[cH:24][cH:25][c:26](-[c:28]3[cH:29][cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][cH:36]3)[cH:27]4)[cH:17][cH:18]2)=[O:38])[n:8][o:9]1.[C:39]([CH3:40])([CH3:41])([CH3:42])[O:43][C:44](=[O:45])[N:46]1[CH2:47][CH2:48][NH:49][CH2:50][CH2:51]1.[CH3:53][N:54]([CH3:55])[CH2:56][CH2:57][CH2:58][N:59]=[C:60]=[N:61][CH2:62][CH3:63].[CH3:64][CH2:65][N:66]([CH2:67][CH3:68])[CH2:69][CH3:70].[ClH:52].[O:81]=[CH:82][N:83]([CH3:84])[CH3:85].[OH:71][n:72]1[c:73]2[cH:74][cH:75][cH:76][cH:77][c:78]2[n:79][n:80]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:10][C:11]([NH:12][c:13]2[c:14]([F:37])[cH:15][c:16](-[c:19]3[cH:20][n:21][c:22]4[n:23]3[cH:24][cH:25][c:26](-[c:28]3[cH:29][cH:30][c:31]([C:32](=[O:33])[N:49]5[CH2:48][CH2:47][N:46]([C:44]([O:43][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:45])[CH2:51][CH2:50]5)[cH:35][cH:36]3)[cH:27]4)[cH:17][cH:18]2)=[O:38])[n:8][o:9]1Participants
8
Sources & evidence
- ORD record
- ord-711e5a26f20e41798aef46d87de92454
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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