Hydrochloric Acid → HCID 178426765, compound
Reaction equation
[C:22]([CH3:23])([CH3:24])([CH3:25])[O:26][C:27](=[O:28])[CH:29]1[CH:30]([C:37](=[O:38])[OH:39])[NH:31][CH2:32][C:33]2([CH2:34][CH2:35]2)[CH2:36]1.[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]([CH2:12][O:13][c:14]2[cH:15][cH:16][c:17]([NH2:20])[cH:18][cH:19]2)[cH:11]1.[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[ClH:21].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH2:54]>>[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]([CH2:12][O:13][c:14]2[cH:15][cH:16][c:17]([NH:20][C:37]([CH:30]3[CH:29]([C:27]([O:26][C:22]([CH3:23])([CH3:24])[CH3:25])=[O:28])[CH2:36][C:33]4([CH2:32][NH:31]3)[CH2:34][CH2:35]4)=[O:38])[cH:18][cH:19]2)[cH:11]1Participants
7
Sources & evidence
- ORD record
- ord-7b2ef078e0f540468feb1564c05bedfb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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