Hydrochloric Acid → HCID 178453720, compound
Reaction equation
[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[CH3:68][CH2:69][OH:70].[CH3:71][CH2:72][O:73][C:74](=[O:75])[CH3:76].[CH:28]1([NH:34][c:35]2[cH:36][c:37]([B:51]([OH:52])[OH:53])[cH:38][cH:39][c:40]2[C:41](=[O:42])[NH:43][S:44](=[O:45])(=[O:46])[CH2:47][CH2:48][CH2:49][OH:50])[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]1.[ClH:60].[Na+:54].[Na+:55].[O-:56][C:57](=[O:58])[O-:59].[OH:1][CH:2]([CH2:3][N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH2:12][CH2:13][O:14][c:15]1[cH:16][cH:17][c:18]([I:21])[cH:19][cH:20]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[OH:1][CH:2]([CH2:3][N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH2:12][CH2:13][O:14][c:15]1[cH:16][cH:17][c:18](-[c:37]2[cH:36][c:35]([NH:34][CH:28]3[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]3)[c:40]([C:41](=[O:42])[NH:43][S:44](=[O:45])(=[O:46])[CH2:47][CH2:48][CH2:49][OH:50])[cH:39][cH:38]2)[cH:19][cH:20]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1Participants
9
Sources & evidence
- ORD record
- ord-fe23d3c63e2d4bd58de44be79ebdddc7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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