Acetic Acid → HCID 67068502, compound

HRID 158648Notes

Reaction equation

HRID 158648 reaction equation
[C:21]([OH:22])(=[O:23])[CH3:24].[CH2:10]([CH3:11])[O:12][C:13](=[O:14])[c:15]1[nH:16][cH:17][cH:18][c:19]1[NH2:20].[CH3:25][CH2:26][OH:27].[O:1]=[c:2]1[cH:3][cH:4][cH:5][c:6]([CH:8]=[O:9])[nH:7]1>>[O:1]=[c:2]1[cH:3][cH:4][cH:5][c:6]([CH2:8][NH:20][c:19]2[c:15]([C:13]([O:12][CH2:10][CH3:11])=[O:14])[nH:16][cH:17][cH:18]2)[nH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 2773439Ethyl 3-amino-1H-pyrrole-2-carboxylateHCID 220188131,6-Dihydro-6-oxopyridine-2-carboxaldehyde

Product 1

HCID 67068502HCID 67068502, compound

Sources & evidence

ORD record
ord-f6dea8949d65468293b5b388cfcfaf97
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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