Acetic Acid → HCID 13469430, compound

HRID 199256Notes

Reaction equation

HRID 199256 reaction equation
[CH3:24][C:25](=[O:26])[OH:27].[CH3:28][OH:29].[K:1][O:2][C:3]#[N:4].[NH2:5][CH2:6][CH2:7][CH2:8][NH:9][c:10]1[cH:11][cH:12][c:13]([C:16]2=[N:21][NH:20][C:19](=[O:22])[NH:18][CH:17]2[CH3:23])[cH:14][cH:15]1.[OH2:30]>>[O:2]=[C:3]([NH2:4])[NH:5][CH2:6][CH2:7][CH2:8][NH:9][c:10]1[cH:11][cH:12][c:13]([C:16]2=[N:21][NH:20][C:19](=[O:22])[NH:18][CH:17]2[CH3:23])[cH:14][cH:15]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 962WaterHCID 13469451HCID 13469451, compoundHCID 178418250HCID 178418250, compound

Product 1

HCID 13469430HCID 13469430, compound

Sources & evidence

ORD record
ord-4ed73d2f89224f09af5b3021867eb21c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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