Ethanol → HCID 178474382, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]1[CH:6]([O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:16]([O:18][CH3:17])=[O:19])[O:20][CH:21]([CH2:47][OH:48])[CH:22]([O:36][CH:37]2[CH:38]([OH:39])[CH:40]([OH:41])[CH:42]([OH:43])[CH:44]([CH3:46])[O:45]2)[CH:23]1[O:24][CH:25]1[CH:26]([OH:27])[CH:28]([OH:29])[CH:30]([OH:31])[CH:32]([CH2:34][OH:35])[O:33]1.[CH3:52][CH2:53][OH:54].[NH2:50][NH2:51].[OH2:49]>>[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]1[CH:6]([O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:16](=[O:18])[NH:50][NH2:51])[O:20][CH:21]([CH2:47][OH:48])[CH:22]([O:36][CH:37]2[CH:38]([OH:39])[CH:40]([OH:41])[CH:42]([OH:43])[CH:44]([CH3:46])[O:45]2)[CH:23]1[O:24][CH:25]1[CH:26]([OH:27])[CH:28]([OH:29])[CH:30]([OH:31])[CH:32]([CH2:34][OH:35])[O:33]1Participants
5
Sources & evidence
- ORD record
- ord-fc3ebca96df74d99ae8591e6e68fa602
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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