Water → HCID 178450477, compound
Reaction equation
[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([NH:14][CH:15]([CH2:16][N:17]1[C:18]([CH3:31])([CH3:32])[CH2:19][N:20]([c:24]2[c:25]([Cl:30])[cH:26][cH:27][cH:28][cH:29]2)[C:21](=[O:23])[CH2:22]1)[CH:33]1[O:34][C:35](=[O:39])[CH:36]([CH3:38])[CH2:37]1)=[O:40].[CH3:41][C:42]([CH2:43][NH2:44])([CH3:45])[CH3:46].[OH2:47].[OH:1][c:2]1[cH:3][cH:4][cH:5][cH:6][n:7]1>>[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([NH:14][CH:15]([CH2:16][N:17]1[C:18]([CH3:31])([CH3:32])[CH2:19][N:20]([c:24]2[c:25]([Cl:30])[cH:26][cH:27][cH:28][cH:29]2)[C:21](=[O:23])[CH2:22]1)[CH:33]([OH:34])[CH2:37][CH:36]([C:35](=[O:39])[NH:44][CH2:43][C:42]([CH3:41])([CH3:45])[CH3:46])[CH3:38])=[O:40]Participants
5
Sources & evidence
- ORD record
- ord-1042662848a14fc7a40120e144d526e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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