Hydrochloric Acid → HCID 54098213, compound
Reaction equation
[CH2:1]1[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[CH3:12][c:13]1[cH:14][cH:15][c:16]2[c:17]([cH:18][c:19](-[c:21]3[cH:22][cH:23][c:24]([CH:27]=[CH:28][c:29]4[c:30]([C:35](=[O:36])[OH:37])[cH:31][cH:32][cH:33][cH:34]4)[cH:25][cH:26]3)[s:20]2)[cH:38]1.[CH3:8][NH:9][CH3:10].[Cl:40][c:41]1[cH:42][cH:43][c:44]2[o:45][c:46](-[c:47]3[cH:48][cH:49][c:50]([CH:51]=[CH:52][c:53]4[cH:54][cH:55][c:56]([C:57]([OH:58])=[O:59])[cH:60][cH:61]4)[cH:62][cH:63]3)[cH:64][c:65]2[cH:66]1.[ClH:7].[K:39].[Na:11]>>[CH2:1]1[CH2:2][CH2:3][N:4]([C:35]([c:30]2[c:29]([CH:28]=[CH:27][c:24]3[cH:23][cH:22][c:21](-[c:19]4[cH:18][c:17]5[c:16]([cH:15][cH:14][c:13]([CH3:12])[cH:38]5)[s:20]4)[cH:26][cH:25]3)[cH:34][cH:33][cH:32][cH:31]2)=[O:36])[CH2:5][CH2:6]1Participants
8
Sources & evidence
- ORD record
- ord-b3558cb8dd724b8994d6d01c4da9f542
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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