Hydrochloric Acid → HCID 42603375, compound
Reaction equation
[C:33]([O:34][BH-:35]([O:36][C:37](=[O:38])[CH3:39])[O:40][C:41](=[O:42])[CH3:43])(=[O:44])[CH3:45].[CH2:31]=[O:32].[CH3:2][O:3][c:4]1[c:5]([N:25]2[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2)[cH:6][c:7]([NH:10][S:11](=[O:12])(=[O:13])[c:14]2[cH:15][cH:16][cH:17][c:18]3[c:22]2[O:21][C:20]([F:23])([F:24])[O:19]3)[cH:8][cH:9]1.[Cl:54][CH2:55][Cl:56].[ClH:1].[Na+:46].[Na+:47].[Na+:48].[O-:49][S:50](=[O:51])(=[O:52])[O-:53]>>[CH3:2][O:3][c:4]1[c:5]([N:25]2[CH2:26][CH2:27][N:28]([CH3:33])[CH2:29][CH2:30]2)[cH:6][c:7]([NH:10][S:11](=[O:12])(=[O:13])[c:14]2[cH:15][cH:16][cH:17][c:18]3[c:22]2[O:21][C:20]([F:23])([F:24])[O:19]3)[cH:8][cH:9]1Participants
8
Sources & evidence
- ORD record
- ord-f6fa5c080d3241a8bad514b0ec34fd60
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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