Reaction equation
[C:1]([CH2:2][CH2:3][CH2:4][CH:5]=[CH:6][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])(=[O:21])[OH:22].[CH2:39]([N:40]([CH2:41][CH3:42])[CH2:43][CH3:44])[CH3:45].[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:51][C:52]#[N:53].[CH3:54][OH:55].[Cl:30][C:31]([O:32][CH2:33][CH2:34][CH2:35][CH3:36])=[O:37].[ClH:38].[ClH:50].[NH2:46][CH2:47][CH2:48][OH:49]>>[C:1]([CH2:2][CH2:3][CH2:4][CH:5]=[CH:6][CH2:7][CH:8]=[CH:9][CH2:10][CH:11]=[CH:12][CH2:13][CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])(=[O:22])[NH:46][CH2:47][CH2:48][OH:49]Participants
8
Sources & evidence
- ORD record
- ord-e78f8b066bab4e72a034e78fe6a60c74
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Linked notes
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