Acetic Acid → HCID 20542286, compound

HRID 664140Notes

Reaction equation

HRID 664140 reaction equation
[C:30]([O-:31])(=[O:32])[O-:33].[CH3:36][C:37](=[O:38])[OH:39].[K+:34].[K+:35].[OH2:40].[OH:28][OH:29].[c:1]1([S:7][CH2:8][CH2:9][O:10][c:11]2[c:12](-[c:19]3[nH:20][c:21]4[c:22]([n:23][cH:24][cH:25][cH:26]4)[n:27]3)[cH:13][cH:14][c:15]([O:17][CH3:18])[cH:16]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7]([CH2:8][CH2:9][O:10][c:11]2[c:12](-[c:19]3[nH:20][c:21]4[c:22]([n:23][cH:24][cH:25][cH:26]4)[n:27]3)[cH:13][cH:14][c:15]([O:17][CH3:18])[cH:16]2)=[O:31])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Sources & evidence

ORD record
ord-f1e638d11bf24c18a1da5d03076b6c54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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