Ethanol → HCID 13747434, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12][c:13]([CH2:15][C:16](=[O:17])[NH:18][CH:19]([c:20]2[c:21]([N:26]3[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[cH:22][cH:23][cH:24][cH:25]2)[CH2:32][OH:33])[cH:14]1.[CH2:36]([CH3:37])[I:38].[CH3:39][CH2:40][OH:41].[H-:34].[Na+:35].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12][c:13]([CH2:15][C:16](=[O:17])[NH:18][CH:19]([c:20]2[c:21]([N:26]3[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]3)[cH:22][cH:23][cH:24][cH:25]2)[CH2:32][O:33][CH2:36][CH3:37])[cH:14]1Participants
7
Sources & evidence
- ORD record
- ord-f8ecc05032d74e0db3fe2ca5d528303b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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