Benzene → HCID 21832133, compound
Reaction equation
[C:51]([BH3-:52])#[N:53].[CH2:12]([CH3:13])[O:14][C:15](=[O:16])[C:17]([CH:18]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[C:24](=[O:25])[O:26][CH2:27][CH3:28])([C:29](=[O:30])[O:31][CH2:32][CH3:33])[c:34]1[cH:35][cH:36][c:37]([O:38][CH2:39][C:40]([CH3:41])=[O:42])[cH:43][cH:44]1.[CH3:55][OH:56].[NH2:1][CH2:2][CH:3]([OH:4])[c:5]1[cH:6][c:7]([Cl:11])[cH:8][cH:9][cH:10]1.[Na+:54].[cH:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[NH:1]([CH2:2][CH:3]([OH:4])[c:5]1[cH:6][c:7]([Cl:11])[cH:8][cH:9][cH:10]1)[CH:40]([CH2:39][O:38][c:37]1[cH:36][cH:35][c:34]([C:17]([C:15]([O:14][CH2:12][CH3:13])=[O:16])([CH:18]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[C:24](=[O:25])[O:26][CH2:27][CH3:28])[C:29](=[O:30])[O:31][CH2:32][CH3:33])[cH:44][cH:43]1)[CH3:41]Participants
7
Sources & evidence
- ORD record
- ord-808fc7639fca4706b544148c9f682453
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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