Acetic Acid → HCID 12811402, compound

HRID 164681Notes

Reaction equation

HRID 164681 reaction equation
[CH3:17][C:18](=[O:19])[OH:20].[CH3:3][O:4][c:5]1[c:6]([OH:14])[cH:7][c:8]([CH3:13])[c:9]([S:11][CH3:12])[cH:10]1.[Na+:16].[OH-:15].[OH:1][OH:2]>>[O:1]=[S:11]([c:9]1[c:8]([CH3:13])[cH:7][c:6]([OH:14])[c:5]([O:4][CH3:3])[cH:10]1)[CH3:12]

Participants

6

Sources & evidence

ORD record
ord-dd29ea3e2b9a4a3ab5ec5c1723d1311e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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