Water → HCID 58074087, compound
Reaction equation
[CH3:31][O:32][CH2:33][C:34](=[O:35])[Cl:36].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[NH2:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([c:11]1[cH:12][c:13]([O:17][CH:18]3[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]3)[n:14][cH:15][n:16]1)[CH2:6][CH2:5]2.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH2:49]>>[NH:1]([c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[N:7]([c:11]1[cH:12][c:13]([O:17][CH:18]3[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]3)[n:14][cH:15][n:16]1)[CH2:6][CH2:5]2)[C:34]([CH2:33][O:32][CH3:31])=[O:35]Participants
6
Sources & evidence
- ORD record
- ord-cf827be72966440ea3d40ca16b67a4f0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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