Acetic Acid → Acetic Acid

HRID 2151378Notes

Reaction equation

HRID 2151378 reaction equation
[CH3:26][CH2:27][OH:28].[CH3:30][C:31](=[O:32])[OH:33].[ClH:1].[OH2:29].[Zn:34].[n:2]1[cH:3][c:4](-[c:12]2[cH:13][cH:14][cH:15][c:16]3[c:20]2-[n:19]2[c:18]([cH:23][cH:22][cH:21]2)[C:17]3=[N:24][OH:25])[cH:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12>>[OH:25][C:27]([CH3:26])=[O:28].[n:2]1[cH:3][c:4](-[c:12]2[cH:13][cH:14][cH:15][c:16]3[c:20]2-[n:19]2[c:18]([cH:23][cH:22][cH:21]2)[CH:17]3[NH2:24])[cH:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12

Participants

8

Sources & evidence

ORD record
ord-19bff7cf90da429b92956c0e533f0533
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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