Toluene → HCID 178476187, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([OH:7])[S:8][CH:9]([CH2:20][O:21][C:22]([CH3:23])=[O:24])[CH:10]([O:16][C:17]([CH3:18])=[O:19])[CH:11]1[O:12][C:13]([CH3:14])=[O:15].[C:25]([CH3:26])(=[O:27])[c:28]1[c:29]([OH:30])[cH:31][c:32]([CH3:36])[cH:33][c:34]1[OH:35].[CH3:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[O:56]=[C:57]([O:58][CH:59]([CH3:60])[CH3:61])[N:62]=[N:63][C:64]([O:65][CH:66]([CH3:67])[CH3:68])=[O:69].[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([O:7][c:34]2[c:28]([C:25]([CH3:26])=[O:27])[c:29]([OH:30])[cH:31][c:32]([CH3:36])[cH:33]2)[S:8][CH:9]([CH2:20][O:21][C:22]([CH3:23])=[O:24])[CH:10]([O:16][C:17]([CH3:18])=[O:19])[CH:11]1[O:12][C:13]([CH3:14])=[O:15]Participants
6
Sources & evidence
- ORD record
- ord-ea6ce0c1b2874ddbb20c8549af4518fc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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