Acetate → HCID 86752518, compound

HRID 166639Notes

Reaction equation

HRID 166639 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11][c:12]2[cH:13][cH:14][c:15]([CH:16]=[O:17])[cH:18][cH:19]2)[cH:9][cH:10]1.[CH3:28][C:29](=[O:30])[O-:31].[CH3:32][C:33](=[O:34])[OH:35].[Na+:27].[S:20]1[C:21](=[S:22])[NH:23][C:24](=[O:25])[CH2:26]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11][c:12]2[cH:13][cH:14][c:15]([CH:16]=[C:26]3[S:20][C:21](=[S:22])[NH:23][C:24]3=[O:25])[cH:18][cH:19]2)[cH:9][cH:10]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 923Sodium ionHCID 1201546RhodanineHCID 21191250HCID 21191250, compound

Product 1

HCID 86752518HCID 86752518, compound

Sources & evidence

ORD record
ord-8d7980604b7e499f8e6ca9b9bb9e115e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…