Acetic Acid → HCID 13562845, compound

HRID 172761Notes

Reaction equation

HRID 172761 reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([NH:7][c:8]2[nH:9][c:10](=[O:19])[c:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[cH:12][n:13]2)[cH:20][cH:21][c:22]1[O:23][CH2:24][CH3:25].[CH3:29][C:30](=[O:31])[OH:32].[Na+:27].[OH-:26].[OH2:28]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][c:6]([NH:7][c:8]2[nH:9][c:10](=[O:19])[c:11]([C:14](=[O:15])[OH:16])[cH:12][n:13]2)[cH:20][cH:21][c:22]1[O:23][CH2:24][CH3:25]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 13562804HCID 13562804, compound

Product 1

HCID 13562845HCID 13562845, compound

Sources & evidence

ORD record
ord-9a44c90f0cfb47ed98edad4de61008a7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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