Toluene → HCID 23082914, compound
Reaction equation
[CH2:30]([P:31]([CH2:32][CH2:33][CH2:34][CH3:35])[CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH3:42].[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[CH3:68][CH2:69][CH2:70][CH2:71][CH2:72][CH3:73].[N:43]([C:44]([N:45]1[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50]1)=[O:51])=[N:52][C:53]([N:54]1[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]1)=[O:60].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][C:10](=[O:11])[O:12][CH3:13])[cH:6][cH:7]1.[c:14]1([C:20](=[CH2:21])[c:22]2[cH:23][c:24]([CH2:28][OH:29])[cH:25][cH:26][cH:27]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][C:10](=[O:11])[O:12][CH3:13])[cH:6][cH:7]1)[CH2:28][c:24]1[cH:23][c:22]([C:20]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)=[CH2:21])[cH:27][cH:26][cH:25]1Participants
7
Sources & evidence
- ORD record
- ord-4ee7f0146f1c46739d234dd015aa6924
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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