Water → HCID 13136841, compound
Reaction equation
[C:23]([CH3:24])([CH3:25])([CH3:26])[O:27][C:28](=[O:29])[O:30][N:31]=[C:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)[C:39]#[N:40].[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1.[OH2:41].[c:1]1([S:7][CH:8]2[CH2:9][CH:10]([C:13](=[O:14])[OH:15])[NH:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7][CH:8]2[CH2:9][CH:10]([C:13](=[O:14])[OH:15])[N:11]([C:28]([O:27][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:29])[CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Sources & evidence
- ORD record
- ord-89aeada632d44ce1a358c04a3f96ab4a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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