Acetic Acid → HCID 54729490, compound

HRID 144558Notes

Reaction equation

HRID 144558 reaction equation
[CH3:32][C:33](=[O:34])[OH:35].[OH:1][c:2]1[c:3]2[c:4]([s:5][c:6]1[C:7](=[O:8])[NH:9][CH:10]=[C:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[cH:24][cH:25][c:26]([S:28][CH3:29])[cH:27]2.[OH:30][OH:31]>>[OH:1][c:2]1[c:3]2[c:4]([s:5][c:6]1[C:7](=[O:8])[NH:9][CH:10]=[C:11]([c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[cH:24][cH:25][c:26]([S:28]([CH3:29])=[O:30])[cH:27]2

Participants

4

Sources & evidence

ORD record
ord-f2b765d92a25410d97a5f31dc694cfe0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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