Ethanol → HCID 23288445, compound

HRID 673315Notes

Reaction equation

HRID 673315 reaction equation
[CH2:27]([OH:28])[CH3:29].[Na+:25].[OH-:24].[OH2:26].[OH:1][c:2]1[c:3]([NH:11][C:12](=[O:13])[NH:14][CH:15]([CH:16]([CH3:17])[CH3:18])[C:19](=[O:20])[O:21][CH2:22][CH3:23])[cH:4][cH:5][c:6]([N+:8](=[O:9])[O-:10])[cH:7]1>>[OH:1][c:2]1[c:3]([NH:11][C:12](=[O:13])[NH:14][C:15]([CH:16]([CH3:17])[CH3:18])=[C:19]=[O:20])[cH:4][cH:5][c:6]([N+:8](=[O:9])[O-:10])[cH:7]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 23288448HCID 23288448, compound

Product 1

HCID 23288445HCID 23288445, compound

Sources & evidence

ORD record
ord-38613b5d78734ea0a8f0a2d6d463367e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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