Hydrochloric Acid → HCID 73654796, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH2:8][O:9][c:10]1[c:11]([CH3:56])[c:12]2[c:17]([c:18]([CH3:21])[c:19]1[CH3:20])[O:16][C:15]([CH3:22])([CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]([CH2:29][C:30]3([CH2:45][C:46](=[O:47])[O:48][C:49]([CH3:50])([CH3:51])[CH3:52])[C:31](=[O:44])[N:32]([CH2:36][C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:33](=[O:35])[S:34]3)[cH:53][cH:54]1)[CH2:14][C:13]2=[O:55].[C:66](=[O:67])([O-:68])[O-:69].[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[CH3:78][OH:79].[ClH:57].[K+:70].[K+:71].[NH2:58][OH:59].[cH:60]1[cH:61][cH:62][n:63][cH:64][cH:65]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH2:8][O:9][c:10]1[c:11]([CH3:56])[c:12]2[c:17]([c:18]([CH3:21])[c:19]1[CH3:20])[O:16][C:15]([CH3:22])([CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]([CH2:29][C:30]3([CH2:45][C:46](=[O:47])[O:48][C:49]([CH3:50])([CH3:51])[CH3:52])[C:31](=[O:44])[N:32]([CH2:36][C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:33](=[O:35])[S:34]3)[cH:53][cH:54]1)[CH2:14][C:13]2=[N:58][OH:59]Participants
9
Sources & evidence
- ORD record
- ord-a72d53de383240b79254ddc2f1d06c6e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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