Toluene → HCID 18947853, compound
Reaction equation
[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][C:20]([CH:21]([NH2:22])[CH2:23][CH:24]([CH3:25])[CH3:26])=[O:27].[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[P:45]([O:46][CH2:47][CH3:48])([O:49][CH2:50][CH3:51])[O-:52].[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1.[c:28]1([CH2:34][CH2:35][CH:36]=[O:37])[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][C:20]([CH:21]([NH:22][CH:36]([CH2:35][CH2:34][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[P:45]([O:46][CH2:47][CH3:48])([O:49][CH2:50][CH3:51])=[O:52])[CH2:23][CH:24]([CH3:25])[CH3:26])=[O:27]Participants
7
Sources & evidence
- ORD record
- ord-770bba4120a943bfbe9c88fc3189a068
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…