Acetate → HCID 86752514, compound

HRID 1206911Notes

Reaction equation

HRID 1206911 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[c:6]1[cH:7][cH:8][c:9]([O:10][c:11]2[cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17][cH:18]2)[cH:19][cH:20]1.[CH3:28][C:29](=[O:30])[OH:31].[CH3:33][C:34](=[O:35])[O-:36].[Na+:32].[S:21]1[C:22](=[S:23])[NH:24][C:25](=[O:26])[CH2:27]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[c:6]1[cH:7][cH:8][c:9]([O:10][c:11]2[cH:12][c:13]([CH:14]=[C:27]3[S:21][C:22](=[S:23])[NH:24][C:25]3=[O:26])[cH:16][cH:17][cH:18]2)[cH:19][cH:20]1

Participants

6

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 923Sodium ionHCID 1201546RhodanineHCID 21191289HCID 21191289, compound

Product 1

HCID 86752514HCID 86752514, compound

Sources & evidence

ORD record
ord-cc21d24d6ba64e7584b2d2130dd93f1d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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