Ethanol → HCID 178494477, compound
Reaction equation
[CH2:1]([O:2][C:3](=[O:4])[N:11]1[CH:12]([c:17]2[n:18][c:19]3[c:20]([nH:21]2)[c:22]2[cH:23][c:24]4[c:25]([cH:26][c:27]2[cH:28][cH:29]3)-[c:30]2[cH:31][cH:32][c:33](-[c:38]3[cH:39][n:40][c:41]([CH:43]5[N:44]([C:51](=[O:52])[O:53][C:54]([CH3:55])([CH3:56])[CH3:57])[CH2:45][CH:46]([CH2:48][O:49][CH3:50])[CH2:47]5)[nH:42]3)[cH:34][c:35]2[CH2:36][O:37]4)[CH2:13][CH2:14][CH:15]1[CH3:16])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:63][CH2:64][OH:65].[Na+:62].[O-:58][C:59]([OH:60])=[O:61]>>[NH:11]1[CH:12]([c:17]2[n:18][c:19]3[c:20]([nH:21]2)[c:22]2[cH:23][c:24]4[c:25]([cH:26][c:27]2[cH:28][cH:29]3)-[c:30]2[cH:31][cH:32][c:33](-[c:38]3[cH:39][n:40][c:41]([CH:43]5[N:44]([C:51](=[O:52])[O:53][C:54]([CH3:55])([CH3:56])[CH3:57])[CH2:45][CH:46]([CH2:48][O:49][CH3:50])[CH2:47]5)[nH:42]3)[cH:34][c:35]2[CH2:36][O:37]4)[CH2:13][CH2:14][CH:15]1[CH3:16]Participants
5
Sources & evidence
- ORD record
- ord-3fa5894c67da40ee804aa2fbad56e6f4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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