Ethanol → HCID 54139776, compound
Reaction equation
[CH3:28][CH2:29][OH:30].[NH2:1][c:2]1[c:3]([N+:25]([O-:26])=[O:27])[cH:4][c:5]([O:6][CH2:7][CH2:8][CH2:9][N:10]2[CH2:11][CH2:12][CH:13]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:23][cH:24]1>>[NH2:1][c:2]1[c:3]([NH2:25])[cH:4][c:5]([O:6][CH2:7][CH2:8][CH2:9][N:10]2[CH2:11][CH2:12][CH:13]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:23][cH:24]1Participants
3
Sources & evidence
- ORD record
- ord-68335bdb0c4749e1aea10334ac57c58b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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