Acetic Acid → HCID 178470143, compound

HRID 307400

Reaction equation

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

Participants

Reactant 6

HCID 176Acetic Acid

HCID 784Hydrogen Peroxide

HCID 962Water

HCID 24465Tungstate

HCID 5360545Sodium

HCID 230495641-Cyclopropylethyl 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Product 1

HCID 178470143HCID 178470143, compound

Sources & evidence

ORD record: ord-63e515690d9b4c9cb0b87f7c962644b7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Linked notes

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