Ethanol → HCID 66777356, compound

HRID 2319181Notes

Reaction equation

HRID 2319181 reaction equation
[CH3:42][CH2:43][OH:44].[CH:1]1([CH:7]([c:8]2[c:9]([CH3:17])[c:10]3[cH:11][n:12][cH:13][cH:14][c:15]3[s:16]2)[NH:18][c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[NH:27][CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:23][cH:24]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:41].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH-:40]>>[CH:1]1([CH:7]([c:8]2[c:9]([CH3:17])[c:10]3[cH:11][n:12][cH:13][cH:14][c:15]3[s:16]2)[NH:18][c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[NH:27][CH2:28][CH2:29][C:30](=[O:31])[OH:32])[cH:23][cH:24]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 66777167HCID 66777167, compound

Product 1

HCID 66777356HCID 66777356, compound

Sources & evidence

ORD record
ord-1d0a78af516a4c569091e9b30ebf2520
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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