Ethanol → HCID 91981564, compound
Reaction equation
[CH2:9]([O:10][P:11](=[O:12])([O:13][CH2:14][CH3:15])[CH:17]1[CH2:18][CH2:19][CH:20]2[CH2:21][O:22][CH2:23][CH:24]([c:28]3[cH:29][c:30]([F:36])[c:31]([F:35])[c:32]([F:34])[cH:33]3)[N:25]2[C:26]1=[O:27])[CH3:16].[CH3:37][O:38][c:39]1[cH:40][c:41]([CH:42]=[O:43])[cH:44][cH:45][c:46]1-[n:47]1[cH:48][n:49][c:50]([CH3:52])[cH:51]1.[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[CH3:60][CH2:61][OH:62].[Li+:3].[O:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1.[OH-:2].[OH2:1].[OH2:53]>>[C:17]1(=[CH:42][c:41]2[cH:40][c:39]([O:38][CH3:37])[c:46](-[n:47]3[cH:48][n:49][c:50]([CH3:52])[cH:51]3)[cH:45][cH:44]2)[CH2:18][CH2:19][CH:20]2[CH2:21][O:22][CH2:23][CH:24]([c:28]3[cH:29][c:30]([F:36])[c:31]([F:35])[c:32]([F:34])[cH:33]3)[N:25]2[C:26]1=[O:27]Participants
9
Sources & evidence
- ORD record
- ord-ea4d4ecd766b4eeeb48e4bc83264928a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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