Ethanol → HCID 53961755, compound

HRID 320045Notes

Reaction equation

HRID 320045 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][c:21]1[s:22][cH:23][c:24]([C:26]([C:27](=[O:28])[O:29][CH2:30][CH3:31])=[N:32][O:33][CH2:34][CH2:35][CH2:36][CH2:37][NH:38][C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[n:25]1.[CH3:48][CH2:49][OH:50].[Na+:47].[O:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[OH-:46]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][c:21]1[s:22][cH:23][c:24]([C:26]([C:27](=[O:28])[OH:29])=[N:32][O:33][CH2:34][CH2:35][CH2:36][CH2:37][NH:38][C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[n:25]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 312751,4-DioxaneHCID 54369019HCID 54369019, compound

Product 1

HCID 53961755HCID 53961755, compound

Sources & evidence

ORD record
ord-e1652b74aef3456185589a1b546c6ab4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…