Hydrochloric Acid → HCID 178471003, compound
Reaction equation
[C:30]([CH3:31])(=[O:32])[S:33][CH:34]([C:35](=[O:36])[OH:37])[CH:38]([CH3:39])[CH3:40].[CH2:2]([CH3:3])[O:4][C:5]([CH:6]([NH:7][C:8]([C:9]([CH3:10])([CH3:11])[NH2:12])=[O:13])[CH2:14][c:15]1[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]1)=[O:22].[CH2:51]1[CH2:52][CH2:53][CH:54]([N:55]=[C:56]=[N:57][CH:58]2[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]2)[CH2:64][CH2:65]1.[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[ClH:1].[OH2:71].[OH:41][n:42]1[c:43]2[n:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[CH2:2]([CH3:3])[O:4][C:5]([CH:6]([NH:7][C:8]([C:9]([CH3:10])([CH3:11])[NH:12][C:35]([CH:34]([S:33][C:30]([CH3:31])=[O:32])[CH:38]([CH3:39])[CH3:40])=[O:36])=[O:13])[CH2:14][c:15]1[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]1)=[O:22]Participants
9
Sources & evidence
- ORD record
- ord-afe42eef523f4a4296d999d968ca5c5c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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