Acetic Acid → Mar 99

HRID 2140291Notes

Reaction equation

HRID 2140291 reaction equation
[CH3:1][CH:2]([CH2:3][O:4][c:5]1[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][cH:22][cH:23]1)[CH3:24].[CH3:28][C:29](=[O:30])[OH:31].[Na+:26].[OH-:25].[OH2:27]>>[CH3:1][CH:2]([CH2:3][O:4][c:5]1[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][cH:22][cH:23]1)[CH3:24]

Participants

6

Sources & evidence

ORD record
ord-9989c364a82c4b42bca2cce7f2035724
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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