Hydrochloric Acid → HCID 178469105, compound
Reaction equation
[Br:26][c:27]1[c:28]([S:38][CH:39]([C:40](=[O:41])[OH:42])[CH2:43][CH2:44][CH2:45][c:46]2[cH:47][cH:48][c:49]([O:52][CH3:53])[cH:50][cH:51]2)[cH:29][cH:30][c:31]([C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:32]1.[C:2]([CH3:3])([CH3:4])([CH3:5])[O:6][C:7]([CH2:8][NH2:9])=[O:10].[CH3:54][N:55]1[CH2:56][CH2:57][O:58][CH2:59][CH2:60]1.[CH:11]1([N:12]=[C:13]=[N:14][CH:15]2[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]2)[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1.[Cl:61][CH2:62][Cl:63].[ClH:1].[OH2:64]>>[C:2]([CH3:3])([CH3:4])([CH3:5])[O:6][C:7]([CH2:8][NH:9][C:40]([CH:39]([S:38][c:28]1[c:27]([Br:26])[cH:32][c:31]([C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:30][cH:29]1)[CH2:43][CH2:44][CH2:45][c:46]1[cH:47][cH:48][c:49]([O:52][CH3:53])[cH:50][cH:51]1)=[O:41])=[O:10]Participants
8
Sources & evidence
- ORD record
- ord-5bafd9a8e4b24b2bbbacad3e4abe9cb2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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