Hydrochloric Acid → HCID 9952290, compound
Reaction equation
[CH3:44][O:45][CH2:46][CH2:47][OH:48].[Cl:1][c:2]1[c:3]([C:18]#[N:19])[cH:4][n:5][c:6]2[cH:7][c:8]([O:15][CH2:16][CH3:17])[c:9]([O:12][CH2:13][CH3:14])[cH:10][c:11]12.[ClH:31].[NH2:20][c:21]1[cH:22][cH:23][c:24]2[c:29]([cH:30]1)[C:27](=[O:28])[O:26][CH2:25]2.[Na+:38].[Na+:39].[O-:40][C:41](=[O:42])[O-:43].[OH2:49].[n:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[c:2]1([NH:20][c:21]2[cH:22][cH:23][c:24]3[c:29]([cH:30]2)[C:27](=[O:28])[O:26][CH2:25]3)[c:3]([C:18]#[N:19])[cH:4][n:5][c:6]2[cH:7][c:8]([O:15][CH2:16][CH3:17])[c:9]([O:12][CH2:13][CH3:14])[cH:10][c:11]12Participants
9
Sources & evidence
- ORD record
- ord-bdf0f1d0b58a48fb9c6d021a38e7112e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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