Ethanol → HCID 22724417, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][c:10]2[c:11]([n:12](-[c:15]3[cH:16][c:17]([C:21]([OH:22])=[O:23])[cH:18][cH:19][cH:20]3)[c:13]1=[O:14])[n:24][cH:25][cH:26][cH:27]2.[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[CH3:58][CH2:59][OH:60].[c:28]1([P:29]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)(=[O:38])[N:42]=[N+:30]=[N-:31])[cH:39][cH:40][cH:41][cH:43][cH:44]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][c:10]2[c:11]([n:12](-[c:15]3[cH:16][c:17]([NH:42][C:55]([O:54][CH2:53][CH3:52])=[O:57])[cH:18][cH:19][cH:20]3)[c:13]1=[O:14])[n:24][cH:25][cH:26][cH:27]2Participants
6
Sources & evidence
- ORD record
- ord-82dd3e63d43e4a2494adc518d8754b71
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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