Ethanol → HCID 9821018, compound

HRID 122683Notes

Reaction equation

HRID 122683 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[NH:7][c:8]1[cH:9][c:10]([C:26]#[N:27])[c:11]([O:15][c:16]2[cH:17][c:18]([CH:23]([CH3:24])[CH3:25])[c:19]([OH:22])[cH:20][cH:21]2)[c:12]([CH3:14])[cH:13]1)=[O:28].[CH3:31][CH2:32][OH:33].[Na+:30].[OH-:29]>>[O:3]=[C:4]([C:5](=[O:6])[NH:7][c:8]1[cH:9][c:10]([C:26]#[N:27])[c:11]([O:15][c:16]2[cH:17][c:18]([CH:23]([CH3:24])[CH3:25])[c:19]([OH:22])[cH:20][cH:21]2)[c:12]([CH3:14])[cH:13]1)[OH:28]

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 15523647HCID 15523647, compound

Product 1

HCID 9821018HCID 9821018, compound

Sources & evidence

ORD record
ord-52fac26bbf044a0cb6ddc54d1bc86c02
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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