Ethanol → HCID 178423748, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][c:8]2[n:9]([CH:10]3[CH:11]([OH:12])[CH:13]([OH:14])[CH:15]([CH2:16][OH:17])[O:18]3)[c:19]3[n:20][cH:21][n:22][c:23]([NH2:26])[c:24]3[n:25]2)[cH:27][cH:28]1.[CH2:46]([O:47][C:48](=[O:49])[CH3:50])[CH3:51].[CH2:52]([O:53][CH2:54][CH3:55])[CH3:56].[CH3:29][c:30]1[cH:31][cH:32][c:33]([B:36]([OH:37])[OH:38])[cH:34][cH:35]1.[CH3:57][CH2:58][OH:59].[Na+:39].[Na+:40].[O-:41][C:42](=[O:43])[O-:44].[OH2:45]>>[c:2]1(-[c:33]2[cH:32][cH:31][c:30]([CH3:29])[cH:35][cH:34]2)[cH:3][cH:4][c:5]([CH2:6][NH:7][c:8]2[n:9]([CH:10]3[CH:11]([OH:12])[CH:13]([OH:14])[CH:15]([CH2:16][OH:17])[O:18]3)[c:19]3[n:20][cH:21][n:22][c:23]([NH2:26])[c:24]3[n:25]2)[cH:27][cH:28]1Participants
9
Sources & evidence
- ORD record
- ord-b9aecd66a17e4090a4214b1b3e2b4948
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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