Acetic Acid → HCID 53680142, compound

HRID 122369Notes

Reaction equation

HRID 122369 reaction equation
[CH3:26][C:27](=[O:28])[O:29][C:30](=[O:31])[CH3:32].[CH3:33][C:34](=[O:35])[OH:36].[OH2:25].[c:1]1([CH:7]2[CH:8]3[C:9](=[N:10][NH:11]2)[C:12](=[CH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[CH2:13][S:14](=[O:16])(=[O:17])[CH2:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH:8]3[C:9](=[N:10][N:11]2[C:27]([CH3:26])=[O:28])[C:12](=[CH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[CH2:13][S:14](=[O:16])(=[O:17])[CH2:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 7918Acetic AnhydrideHCID 68137094HCID 68137094, compound

Product 1

HCID 53680142HCID 53680142, compound

Sources & evidence

ORD record
ord-385bec5718b34e5ca25df901efd8425b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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