Acetate → HCID 86752512, compound

HRID 692384Notes

Reaction equation

HRID 692384 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[cH:10][cH:11][c:12]([CH2:13][O:14][c:15]2[cH:16][c:17]([CH:18]=[O:19])[cH:20][cH:21][cH:22]2)[cH:23][cH:24]1.[CH3:33][C:34](=[O:35])[O-:36].[CH3:37][C:38](=[O:39])[OH:40].[Na+:32].[S:25]1[C:26](=[S:27])[NH:28][C:29](=[O:30])[CH2:31]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[cH:10][cH:11][c:12]([CH2:13][O:14][c:15]2[cH:16][c:17]([CH:18]=[C:31]3[S:25][C:26](=[S:27])[NH:28][C:29]3=[O:30])[cH:20][cH:21][cH:22]2)[cH:23][cH:24]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 923Sodium ionHCID 1201546RhodanineHCID 21191286HCID 21191286, compound

Product 1

HCID 86752512HCID 86752512, compound

Sources & evidence

ORD record
ord-f2a4fa094a75498b8d1c53f742802385
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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