Acetic Acid → HCID 59843462, compound

HRID 107677Notes

Reaction equation

HRID 107677 reaction equation
[C:38]([OH:39])(=[O:40])[CH3:41].[CH3:1][N:2]1[CH2:3][c:4]2[nH:5][c:6]3[cH:7][cH:8][c:9]([NH:15][S:16](=[O:17])(=[O:18])[c:19]4[cH:20][cH:21][c:22]([NH:25][C:26](=[O:27])[CH3:28])[cH:23][cH:24]4)[cH:10][c:11]3[c:12]2[CH2:13][CH2:14]1.[CH3:32][CH2:33][O:34][C:35]([CH3:36])=[O:37].[Na+:30].[OH-:29].[OH2:31]>>[CH3:1][N:2]1[CH2:3][c:4]2[nH:5][c:6]3[cH:7][cH:8][c:9]([NH:15][S:16](=[O:17])(=[O:18])[c:19]4[cH:20][cH:21][c:22]([NH2:25])[cH:23][cH:24]4)[cH:10][c:11]3[c:12]2[CH2:13][CH2:14]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8857Ethyl AcetateHCID 59843475HCID 59843475, compound

Product 1

HCID 59843462HCID 59843462, compound

Sources & evidence

ORD record
ord-16a22bcfd1ac42f7bb030753936b100d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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