Acetic Acid → HCID 72644366, compound

HRID 287058Notes

Reaction equation

HRID 287058 reaction equation
[CH3:24][C:25](=[O:26])[OH:27].[ClH:23].[O:1]=[C:2]1[S:3][C:4](=[CH:8][c:9]2[cH:10][cH:11][c:12]([O:21][CH3:22])[c:13]([CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[cH:14]2)[C:5](=[O:7])[NH:6]1.[OH2:28]>>[O:1]=[C:2]1[S:3][C:4](=[CH:8][c:9]2[cH:10][cH:11][c:12]([O:21][CH3:22])[c:13]([CH2:15][C:16](=[O:17])[OH:18])[cH:14]2)[C:5](=[O:7])[NH:6]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 962WaterHCID 72644365HCID 72644365, compound

Product 1

HCID 72644366HCID 72644366, compound

Sources & evidence

ORD record
ord-e996c96c6b914cb08f2b9c4a50a58268
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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