Hydroxide → 2-((Tert-butoxycarbonyl)amino)-3-(4-carbamoyl-2,6-dimethylphenyl)propanoic acid

HRID 125866Notes

Reaction equation

HRID 125866 reaction equation
[CH2:28]1[O:29][CH2:30][CH2:31][CH2:32]1.[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:16])[cH:8][c:9]([C:13]([NH2:14])=[O:15])[cH:10][c:11]1[CH3:12])[NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25].[Li+:27].[OH-:26]>>[O:2]=[C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:16])[cH:8][c:9]([C:13]([NH2:14])=[O:15])[cH:10][c:11]1[CH3:12])[NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[OH:25]

Participants

5

Reactant 4

HCID 961HydroxideHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 235707192-tert-Butoxycarbonylamino-3-(4-carbamoyl-2,6-dimethyl-phenyl)-propionic acid methyl ester

Product 1

HCID 221476672-((Tert-butoxycarbonyl)amino)-3-(4-carbamoyl-2,6-dimethylphenyl)propanoic acid

Sources & evidence

ORD record
ord-f1fe282679524096b46855da63729fc6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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