p-Toluenesulfonic acid → HCID 66650393, compound
Reaction equation
[C:28](=[O:29])([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[N:35]1[CH2:36][CH2:37][CH:38]([C:41](=[O:42])[OH:43])[CH2:39][CH2:40]1.[CH2:51]([P:52]([OH:53])(=[O:54])[OH:55])[CH2:56][CH3:57].[CH3:44][N:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1.[CH3:58][CH2:59][O:60][C:61]([CH3:62])=[O:63].[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[NH2:12][CH:13]([C:14](=[O:15])[c:16]1[cH:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([F:22])[cH:20][cH:21]1)[CH3:27].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[NH:12]([CH:13]([C:14](=[O:15])[c:16]1[cH:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([F:22])[cH:20][cH:21]1)[CH3:27])[C:41]([CH:38]1[CH2:37][CH2:36][N:35]([C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[CH2:40][CH2:39]1)=[O:42]Participants
8
Sources & evidence
- ORD record
- ord-3b3d5ca2416a45958f32558a16101d23
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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