Ethanol → HCID 22494632, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([c:17]3[cH:18][cH:19][c:20]([N:23]4[CH2:24][CH2:25][CH:26]([S:29][CH2:30][CH2:31][CH3:32])[CH2:27][CH2:28]4)[cH:21][cH:22]3)[CH2:15][CH2:16]2)[cH:9][cH:10]1)=[O:33].[CH3:36][CH2:37][OH:38].[Na+:35].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:34]>>[O:3]=[C:4]([c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([c:17]3[cH:18][cH:19][c:20]([N:23]4[CH2:24][CH2:25][CH:26]([S:29][CH2:30][CH2:31][CH3:32])[CH2:27][CH2:28]4)[cH:21][cH:22]3)[CH2:15][CH2:16]2)[cH:9][cH:10]1)[OH:33]Participants
6
Sources & evidence
- ORD record
- ord-b77e2fddceed42bf8ca2156adca375e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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