Water → HCID 178469045, compound
Reaction equation
[C:1](#[N:2])[c:3]1[c:4]([CH:24]=[CH:25][C:26](=[O:27])[OH:28])[n:5]([CH:14]2[CH2:15][CH2:16][CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]32)[c:6]2[n:7][c:8]([CH3:13])[cH:9][c:10]([CH3:12])[c:11]12.[C:29]([Cl:30])(=[O:31])[C:32]([Cl:33])=[O:34].[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:35][CH2:36][O:37][C:38](=[O:39])[c:40]1[cH:41][cH:42][c:43]([NH2:44])[cH:45][cH:46]1.[O:59]=[CH:60][N:61]([CH3:62])[CH3:63].[OH2:58].[cH:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1>>[C:1](#[N:2])[c:3]1[c:4]([CH:24]=[CH:25][C:26](=[O:27])[NH:44][c:43]2[cH:42][cH:41][c:40]([C:38]([O:37][CH2:36][CH3:35])=[O:39])[cH:46][cH:45]2)[n:5]([CH:14]2[CH2:15][CH2:16][CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]32)[c:6]2[n:7][c:8]([CH3:13])[cH:9][c:10]([CH3:12])[c:11]12Participants
8
Sources & evidence
- ORD record
- ord-dd6c1dea231f45f48a3c53ab352753c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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