Ethanol → HCID 54060562, compound

HRID 1220072Notes

Reaction equation

HRID 1220072 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][c:11]1[cH:12][c:13]([O:30][CH3:31])[c:14]([O:17][CH:18]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[C:25](=[O:26])[O:27][CH2:28][CH3:29])[cH:15][cH:16]1)[cH:32][cH:33][c:34]([NH:36][C:37](=[O:38])[N:39]([CH3:40])[CH3:41])[cH:35]2.[CH3:44][CH2:45][OH:46].[Na+:43].[OH-:42]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]2[c:8]([n:9]1[CH2:10][c:11]1[cH:12][c:13]([O:30][CH3:31])[c:14]([O:17][CH:18]([c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[C:25](=[O:26])[OH:27])[cH:15][cH:16]1)[cH:32][cH:33][c:34]([NH:36][C:37](=[O:38])[N:39]([CH3:40])[CH3:41])[cH:35]2

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 53975765HCID 53975765, compound

Product 1

HCID 54060562HCID 54060562, compound

Sources & evidence

ORD record
ord-4cea28c65024469d9e55a27020c51ba1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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