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Sodium Ion → 2-{[(4-Fluorophenyl)sulfonyl]amino}-3-methylbutanoic acid

HRID 108452
Notes
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Reaction equation

HRID 108452 reaction equation
[C:34]([O:35][CH2:36][CH3:37])(=[O:38])[CH3:39].[CH3:1][CH:2]([CH3:3])[CH:4]([NH2:5])[C:6]([OH:7])=[O:8].[CH3:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[F:10][c:11]1[cH:12][cH:13][c:14]([S:17](=[O:18])(=[O:19])[Cl:20])[cH:15][cH:16]1.[Na+:28].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[OH-:27].[OH2:9]>>[CH3:1][CH:2]([CH3:3])[CH:4]([NH:5][S:17]([c:14]1[cH:13][cH:12][c:11]([F:10])[cH:16][cH:15]1)(=[O:18])=[O:19])[C:6]([OH:7])=[O:8]
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 1182DL-valineHCID 8028TetrahydrofuranHCID 8058Hexane2×HCID 8857Ethyl Acetate2×
HCID 9588
4-Fluorobenzenesulfonyl chloride

Product 1

HCID 27747452-{[(4-Fluorophenyl)sulfonyl]amino}-3-methylbutanoic acid

Sources & evidence

ORD record
ord-572e341e90d54fbb9b45c26c23f9eb13
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