Hydroxide → 2-[[2-(2-Methylphenyl)-4-(thiophen-2-ylmethoxymethyl)benzoyl]amino]-4-methylsulfanylbutanoic acid

HRID 170032

Reaction equation

HRID 170032 reaction equation
[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6]([c:7]1[c:8](-[c:21]2[c:22]([CH3:27])[cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]([CH2:13][O:14][CH2:15][c:16]2[s:17][cH:18][cH:19][cH:20]2)[cH:11][cH:12]1)=[O:28])[CH2:29][CH2:30][S:31][CH3:32])=[O:33].[Li+:36].[OH-:35].[OH2:34].[OH2:37]>>[O:2]=[C:3]([CH:4]([NH:5][C:6]([c:7]1[c:8](-[c:21]2[c:22]([CH3:27])[cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]([CH2:13][O:14][CH2:15][c:16]2[s:17][cH:18][cH:19][cH:20]2)[cH:11][cH:12]1)=[O:28])[CH2:29][CH2:30][S:31][CH3:32])[OH:33]

Participants

5

Reactant 4

HCID 961HydroxideHCID 962Water2×HCID 28486Lithium ionHCID 22014042Methyl 2-[[2-(2-methylphenyl)-4-(thiophen-2-ylmethoxymethyl)benzoyl]amino]-4-methylsulfanylbutanoate

Product 1

HCID 702229632-[[2-(2-Methylphenyl)-4-(thiophen-2-ylmethoxymethyl)benzoyl]amino]-4-methylsulfanylbutanoic acid

Sources & evidence

ORD record
ord-fff1205521364f17a04e0224febd3fbd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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