Ethanol → HCID 9934999, compound
Reaction equation
[CH3:41][CH2:42][OH:43].[Na+:40].[OH-:39].[c:1]1([CH3:38])[c:2]([NH:7][c:8]2[o:9][c:10]3[c:11]([n:12]2)[cH:13][cH:14][c:15]([CH2:17][C:18](=[O:19])[NH:20][c:21]2[cH:22][cH:23][c:24]([CH:30]([CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[CH3:37])[c:25]4[c:29]2[CH2:28][CH2:27][CH2:26]4)[cH:16]3)[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH3:38])[c:2]([NH:7][c:8]2[o:9][c:10]3[c:11]([n:12]2)[cH:13][cH:14][c:15]([CH2:17][C:18](=[O:19])[NH:20][c:21]2[cH:22][cH:23][c:24]([CH:30]([CH2:31][C:32](=[O:33])[OH:34])[CH3:37])[c:25]4[c:29]2[CH2:28][CH2:27][CH2:26]4)[cH:16]3)[cH:3][cH:4][cH:5][cH:6]1Participants
5
Sources & evidence
- ORD record
- ord-a6ffe0dc021a4c27851c9dc2edf5852f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)