Benzene → HCID 69801596, compound
Reaction equation
[CH2:15]([P:16]([CH2:17][CH2:18][CH2:19][CH3:20])[CH2:21][CH2:22][CH2:23][CH3:24])[CH2:25][CH2:26][CH3:27].[CH2:28]([CH3:29])[O:30][C:31]([CH:32]([CH2:33][c:34]1[cH:35][cH:36][c:37]([OH:40])[cH:38][cH:39]1)[O:41][CH2:42][CH3:43])=[O:44].[N:45]([C:46]([N:47]1[CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]1)=[O:53])=[N:54][C:55]([N:56]1[CH2:57][CH2:58][CH2:59][CH2:60][CH2:61]1)=[O:62].[cH:1]1[c:2]([CH:11]=[CH:12][CH2:13][OH:14])[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12.[cH:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[cH:1]1[c:2]([CH:11]=[CH:12][CH2:13][O:14][c:37]2[cH:36][cH:35][c:34]([CH2:33][CH:32]([C:31]([O:30][CH2:28][CH3:29])=[O:44])[O:41][CH2:42][CH3:43])[cH:39][cH:38]2)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12Participants
6
Sources & evidence
- ORD record
- ord-4bdf11637ce044cb8c745df2c4779385
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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