Hydrochloric Acid → HCID 54206503, compound
Reaction equation
[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[O:14][C:15](=[O:16])[C:17]1=[C:24]([CH:25]=[CH:26][N:27]([CH3:28])[CH3:29])[CH2:23][O:22][CH:21]2[N:18]1[C:19](=[O:62])[CH:20]2[NH:30][C:31]([C:32]([c:33]1[n:34][c:35]([NH:38][C:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[s:36][cH:37]1)=[N:58][O:59][CH3:60])=[O:61].[ClH:63]>>[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[O:14][C:15](=[O:16])[C:17]1=[C:24]([CH2:25][CH:26]=[O:66])[CH2:23][O:22][CH:21]2[N:18]1[C:19](=[O:62])[CH:20]2[NH:30][C:31]([C:32]([c:33]1[n:34][c:35]([NH:38][C:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[s:36][cH:37]1)=[N:58][O:59][CH3:60])=[O:61]Participants
4
Sources & evidence
- ORD record
- ord-dff522a3d5604e478b31583c9d82b3e0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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