Acetic Acid → HCID 60205259, compound

HRID 1139276Notes

Reaction equation

HRID 1139276 reaction equation
[CH3:1][CH:2]1[CH:3]([NH:8][P:9]([O:10][CH2:11][CH3:12])([O:13][CH2:14][CH3:15])=[O:16])[CH2:4][NH:5][CH2:6][CH2:7]1.[CH3:25][C:26](=[O:27])[OH:28].[CH3:29][OH:30].[CH:17](=[O:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1>>[CH3:1][CH:2]1[CH:3]([NH:8][P:9]([O:10][CH2:11][CH3:12])([O:13][CH2:14][CH3:15])=[O:16])[CH2:4][N:5]([CH2:17][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 240BenzaldehydeHCID 887MethanolHCID 67045186HCID 67045186, compound

Product 1

HCID 60205259HCID 60205259, compound

Sources & evidence

ORD record
ord-224a83b8f82046cc9e8d421aafe7587e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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