Sodium ion → 3-[4-[3-[4-(4-Acetylphenyl)phenyl]but-2-enoxy]phenyl]-2-ethoxypropanoic acid

HRID 1133775Notes

Reaction equation

HRID 1133775 reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][cH:12][c:13]([C:16](=[CH:17][CH2:18][O:19][c:20]3[cH:21][cH:22][c:23]([CH2:26][CH:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[O:33][CH2:34][CH3:35])[cH:24][cH:25]3)[CH3:36])[cH:14][cH:15]2)[cH:8][cH:9]1.[Na+:38].[OH-:37]>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][cH:12][c:13]([C:16](=[CH:17][CH2:18][O:19][c:20]3[cH:21][cH:22][c:23]([CH2:26][CH:27]([C:28](=[O:29])[OH:30])[O:33][CH2:34][CH3:35])[cH:24][cH:25]3)[CH3:36])[cH:14][cH:15]2)[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 923Sodium ionHCID 961HydroxideHCID 178471027HCID 178471027, compound

Product 1

HCID 697958413-[4-[3-[4-(4-Acetylphenyl)phenyl]but-2-enoxy]phenyl]-2-ethoxypropanoic acid

Sources & evidence

ORD record
ord-e0adb55820fe4c51af5fd97f0fd2c84c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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