Hydrochloric Acid → HCID 22184968, compound
Reaction equation
[C:36]([CH3:37])([CH3:38])([CH3:39])[O:40][C:41]([CH2:42][NH2:43])=[O:44].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[CH:14]([CH2:15][CH2:16][C:17](=[O:18])[OH:19])[NH:20][C:21](=[O:22])[c:23]2[n:24][c:25]3[cH:26][cH:27][cH:28][cH:29][c:30]3[c:31]([O:33][CH3:34])[cH:32]2)[CH2:10][CH2:11]1.[CH3:45][N:46]([CH3:47])[CH2:48][CH2:49][CH2:50][N:51]=[C:52]=[N:53][CH2:54][CH3:55].[CH:66]([N:67]([CH:68]([CH3:69])[CH3:70])[CH2:71][CH3:72])([CH3:73])[CH3:74].[ClH:35].[O:75]1[CH2:76][CH2:77][CH2:78][CH2:79]1.[OH:56][n:57]1[c:58]2[cH:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH2:8][N:9]([C:12](=[O:13])[CH:14]([CH2:15][CH2:16][C:17](=[O:18])[NH:43][CH2:42][C:41]([O:40][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:44])[NH:20][C:21](=[O:22])[c:23]2[n:24][c:25]3[cH:26][cH:27][cH:28][cH:29][c:30]3[c:31]([O:33][CH3:34])[cH:32]2)[CH2:10][CH2:11]1Participants
8
Sources & evidence
- ORD record
- ord-5b0bd1d77c5d476c9e7d9ceadfe6d917
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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