Ethanol → HCID 59295549, compound
Reaction equation
[CH2:26]1[O:27][CH2:28][CH2:29][CH2:30]1.[CH3:1][C:2]1([CH3:22])[CH2:3][O:4][C:5]2([CH2:6][CH2:7][c:8]3[c:9]([n:10][cH:11][c:12]([N+:14]([O-:15])=[O:16])[cH:13]3)[CH2:17][CH2:18][CH2:19]2)[O:20][CH2:21]1.[CH3:23][CH2:24][OH:25]>>[CH3:1][C:2]1([CH3:22])[CH2:3][O:4][C:5]2([CH2:6][CH2:7][c:8]3[c:9]([n:10][cH:11][c:12]([NH2:14])[cH:13]3)[CH2:17][CH2:18][CH2:19]2)[O:20][CH2:21]1Participants
4
Sources & evidence
- ORD record
- ord-e67e4f9c0a25454282fa60eb2435f28b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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