Ethanol → HCID 178428933, compound

HRID 308402Notes

Reaction equation

HRID 308402 reaction equation
[CH3:1][c:2]1[n:3][c:4]([CH3:38])[cH:5][c:6]([O:19][CH2:20][c:21]2[cH:22][cH:23][c:24](-[c:27]3[c:28](-[c:33]4[n:34][n:35][n:36][nH:37]4)[cH:29][cH:30][cH:31][cH:32]3)[cH:25][cH:26]2)[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[cH:12][cH:13]1.[CH3:41][CH2:42][OH:43].[Na+:40].[OH-:39]>>[CH3:1][c:2]1[n:3][c:4]([CH3:38])[cH:5][c:6]([O:19][CH2:20][c:21]2[cH:22][cH:23][c:24](-[c:27]3[c:28](-[c:33]4[n:34][n:35][n:36][nH:37]4)[cH:29][cH:30][cH:31][cH:32]3)[cH:25][cH:26]2)[c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:14](=[O:15])[OH:16])[cH:12][cH:13]1

Participants

5

Sources & evidence

ORD record
ord-8a16224deb1d4d0382cd800d28d46b37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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