Benzene → HCID 86736763, compound
Reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:8][CH:9]([CH2:10][CH2:11][O:12][c:13]1[cH:14][cH:15][c:16]([N:19]([CH:20]2[C:21](=[O:33])[N:22]([CH:24]([C:25](=[O:26])[OH:27])[c:28]3[s:29][cH:30][cH:31][cH:32]3)[CH2:23]2)[C:34]([CH:35]=[O:36])=[O:37])[cH:17][cH:18]1)[C:38](=[O:39])[OH:40])([CH3:5])([CH3:6])[CH3:7].[CH3:62][CH2:63][O:64][CH2:65][CH3:66].[F:55][C:56]([F:57])([F:58])[C:59]([OH:60])=[O:61].[c:47]1([O:48][CH3:49])[cH:50][cH:51][cH:52][cH:53][cH:54]1.[cH:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[NH2:8][CH:9]([CH2:10][CH2:11][O:12][c:13]1[cH:14][cH:15][c:16]([N:19]([CH:20]2[C:21](=[O:33])[N:22]([CH:24]([C:25](=[O:26])[OH:27])[c:28]3[s:29][cH:30][cH:31][cH:32]3)[CH2:23]2)[C:34]([CH:35]=[O:36])=[O:37])[cH:17][cH:18]1)[C:38](=[O:39])[OH:40]Participants
6
Sources & evidence
- ORD record
- ord-c0b669ccd5544b9eac015553309a2545
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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