Ethanol → HCID 45110122, compound

HRID 207702Notes

Reaction equation

HRID 207702 reaction equation
[CH3:1][C:2]([CH:3]([CH3:4])[O:5][CH:6]1[CH2:7][CH2:8][CH2:9][CH2:10][O:11]1)([CH3:12])[c:13]1[n:14][o:15][c:16]([NH:18][C:19]([C:20]([CH3:21])([S:22](=[O:23])(=[O:24])[CH:25]2[CH2:26][CH2:27][O:28][CH2:29][CH2:30]2)[CH3:31])=[O:32])[cH:17]1.[CH3:50][CH2:51][OH:52].[c:33]1([CH3:34])[cH:35][cH:36][c:37]([S:38]([O-:39])(=[O:40])=[O:41])[cH:42][cH:43]1.[nH+:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[CH3:1][C:2]([CH:3]([CH3:4])[OH:5])([CH3:12])[c:13]1[n:14][o:15][c:16]([NH:18][C:19]([C:20]([CH3:21])([S:22](=[O:23])(=[O:24])[CH:25]2[CH2:26][CH2:27][O:28][CH2:29][CH2:30]2)[CH3:31])=[O:32])[cH:17]1

Participants

5

Reactant 4

HCID 702EthanolHCID 85570p-ToluenesulfonateHCID 4989215PyridiniumHCID 59253279HCID 59253279, compound

Product 1

HCID 45110122HCID 45110122, compound

Sources & evidence

ORD record
ord-3381d9ca2c59498180846fb21be7111a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…