Methanol → 4-(4-But-2-ynyloxybenzenesulfonyl)-1-[(2,2,5-trimethyl-1,3-dioxan-5-yl)carbonyl]-4-piperidinecarboxylic acid

HRID 1220128Notes

Reaction equation

HRID 1220128 reaction equation
[CH2:1]([C:2]#[C:3][CH3:4])[O:5][c:6]1[cH:7][cH:8][c:9]([S:12](=[O:13])(=[O:14])[C:15]2([C:32](=[O:33])[O:34][CH3:35])[CH2:16][CH2:17][N:18]([C:21](=[O:22])[C:23]3([CH3:31])[CH2:24][O:25][C:26]([CH3:29])([CH3:30])[O:27][CH2:28]3)[CH2:19][CH2:20]2)[cH:10][cH:11]1.[CH3:38][OH:39].[Na+:37].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:36]>>[CH2:1]([C:2]#[C:3][CH3:4])[O:5][c:6]1[cH:7][cH:8][c:9]([S:12](=[O:13])(=[O:14])[C:15]2([C:32](=[O:33])[OH:34])[CH2:16][CH2:17][N:18]([C:21](=[O:22])[C:23]3([CH3:31])[CH2:24][O:25][C:26]([CH3:29])([CH3:30])[O:27][CH2:28]3)[CH2:19][CH2:20]2)[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 23513863HCID 23513863, compound

Product 1

HCID 235138744-(4-But-2-ynyloxybenzenesulfonyl)-1-[(2,2,5-trimethyl-1,3-dioxan-5-yl)carbonyl]-4-piperidinecarboxylic acid

Sources & evidence

ORD record
ord-7aade53113dd4d7597b7388179a127f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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