Ethanol → HCID 66850696, compound
Reaction equation
[CH2:26]1[CH2:27][CH:28]=[CH:29][CH2:30][CH2:31]1.[CH3:32][CH2:33][OH:34].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]([N:13]2[CH2:14][CH2:15][N:16]([CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:17][CH2:18]2)[cH:11][cH:12]1>>[NH2:1][c:4]1[c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]([N:13]2[CH2:14][CH2:15][N:16]([CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:17][CH2:18]2)[cH:11][cH:12]1Participants
4
Sources & evidence
- ORD record
- ord-ea0d4df70333449f9ee2880f0ad9e117
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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