Ethanol → HCID 178511878, compound
Reaction equation
[C:40](=[O:41])([O-:42])[OH:43].[CH3:31][CH2:32][OH:33].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[IH:21].[NH2:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[N:8]([CH2:12][CH2:13][CH2:14][N:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1)[C:7](=[O:20])[CH2:6][CH2:5]2.[Na+:44].[s:22]1[c:23]([C:27](=[NH:28])[S:29][CH3:30])[cH:24][cH:25][cH:26]1>>[NH:1]([c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[N:8]([CH2:12][CH2:13][CH2:14][N:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1)[C:7](=[O:20])[CH2:6][CH2:5]2)[C:27]([c:23]1[s:22][cH:26][cH:25][cH:24]1)=[NH:28]Participants
8
Sources & evidence
- ORD record
- ord-50f7cc945b004bb18ac97a4e70f4fb17
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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