Benzene → HCID 9913001, compound
Reaction equation
[CH2:20]([P:21]([CH2:22][CH2:23][CH2:24][CH3:25])[CH2:26][CH2:27][CH2:28][CH3:29])[CH2:30][CH2:31][CH3:32].[CH2:33]([CH3:34])[O:35][C:36]([CH:37]([CH2:38][c:39]1[cH:40][cH:41][c:42]([OH:45])[cH:43][cH:44]1)[O:46][CH2:47][CH3:48])=[O:49].[CH3:1][c:2]1[o:3][c:4]2[c:10]([n:11]1)[CH:9]([O:12][CH2:13][CH2:14][OH:15])[c:8]1[c:7]([cH:19][cH:18][cH:17][cH:16]1)[CH2:6][CH2:5]2.[N:50]([C:51]([N:52]1[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]1)=[O:58])=[N:59][C:60]([N:61]1[CH2:62][CH2:63][CH2:64][CH2:65][CH2:66]1)=[O:67].[OH2:74].[cH:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[CH3:1][c:2]1[o:3][c:4]2[c:10]([n:11]1)[CH:9]([O:12][CH2:13][CH2:14][O:15][c:42]1[cH:41][cH:40][c:39]([CH2:38][CH:37]([C:36]([O:35][CH2:33][CH3:34])=[O:49])[O:46][CH2:47][CH3:48])[cH:44][cH:43]1)[c:8]1[c:7]([cH:19][cH:18][cH:17][cH:16]1)[CH2:6][CH2:5]2Participants
7
Sources & evidence
- ORD record
- ord-66fac2318b0c4f4ab77ca8e4324d0fd8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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