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Acetate → 4-Tert-butylsulfonyl-3-(hydroxymethyl)azetidin-2-one

HRID 116197
Notes
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Reaction equation

HRID 116197 reaction equation
[C:61]([O-:62])(=[O:63])[CH3:64].[C:66]([O-:67])(=[O:68])[CH3:69].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]2[C:9](=[O:21])[CH:10]([CH2:19][OH:20])[CH:11]2[S:12](=[O:13])(=[O:14])[C:15]([CH3:16])([CH3:17])[CH3:18])[cH:22][cH:23]1.[CH3:43][C:44]#[N:45].[Cu+2:65].[Fe+2:59].[K+:41].[K+:42].[Na+:34].[Na+:35].[OH2:46].[OH2:47].[OH2:48].[OH2:49].[OH2:50].[OH2:51].[OH2:52].[OH2:53].[OH2:60].[P:36]([O-:37])([O-:38])([OH:39])=[O:40].[S:24]([O:25][O:26][S:27]([O-:28])(=[O:29])=[O:30])([O-:31])(=[O:32])=[O:33].[S:54]([O-:55])([O-:56])(=[O:57])=[O:58]>>[NH:8]1[C:9](=[O:21])[CH:10]([CH2:19][OH:20])[CH:11]1[S:12](=[O:13])(=[O:14])[C:15]([CH3:16])([CH3:17])[CH3:18]
ParticipantsSources & evidenceReaction notes

Participants

12

Reactant 11

HCID 175Acetate2×HCID 813Potassium Cation2×HCID 923Sodium Ion2×HCID 962Water9×HCID 1117Sulfate IonHCID 6342AcetonitrileHCID 27099Cupric cation
HCID 27284
Ferrous cation
HCID 107879Peroxydisulfate
HCID 3681305Hydrogen phosphate
HCID 202328114-Tert-butylsulfonyl-3-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]azetidin-2-one

Product 1

HCID 202328104-Tert-butylsulfonyl-3-(hydroxymethyl)azetidin-2-one

Sources & evidence

ORD record
ord-dcb017a71e4f4b0f977a18ed7f517fee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes