Hydrochloric Acid → HCID 178453686, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH:9]1[CH2:10][O:11][c:12]2[c:13]([cH:34][cH:35][c:36]([F:38])[cH:37]2)-[c:14]2[n:15]([c:17]3[cH:18][c:19]([C:30](=[O:31])[O:32][CH3:33])[cH:20][cH:21][c:22]3[c:23]2[CH:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[CH2:16]1)[CH2:39][CH2:40][NH:41][C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48].[ClH:51].[K+:50].[O:52]1[CH2:53][CH2:54][O:55][CH2:56][CH2:57]1.[OH-:49]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH:9]1[CH2:10][O:11][c:12]2[c:13]([cH:34][cH:35][c:36]([F:38])[cH:37]2)-[c:14]2[n:15]([c:17]3[cH:18][c:19]([C:30](=[O:31])[OH:32])[cH:20][cH:21][c:22]3[c:23]2[CH:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[CH2:16]1)[CH2:39][CH2:40][NH:41][C:42](=[O:43])[O:44][C:45]([CH3:46])([CH3:47])[CH3:48]Participants
6
Sources & evidence
- ORD record
- ord-aa669e43747b47518d21d7fe6a070556
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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