Acetic Acid → HCID 178432392, compound

HRID 314995Notes

Reaction equation

HRID 314995 reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[O:14]=[CH:15][N:16]([CH3:17])[CH3:18].[OH:1][c:2]1[cH:3][c:4]([CH2:12][OH:13])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:11])[n:10]2.[c:19]1([CH3:20])[cH:21][cH:22][c:23]([S:25]([OH:24])(=[O:26])=[O:27])[cH:28][cH:29]1>>[c:2]1([SH:25])[cH:3][c:4]([CH2:12][OH:13])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:11])[n:10]2

Participants

5

Sources & evidence

ORD record
ord-ee68286002174a458205136486136eac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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