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Sodium Ion → 4-({[5'-(hydroxymethyl)-2,2',6-trimethylbiphenyl-4-yl]oxy}methyl)tetrahydro-2H-thiopyran-4-ol

HRID 2161211
Notes
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Reaction equation

HRID 2161211 reaction equation
[Al+3:30].[H-:29].[H-:32].[H-:33].[H-:34].[Li+:31].[Na+:50].[Na+:51].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:35].[OH2:36].[OH2:37].[OH2:38].[OH2:39].[OH2:40].[OH2:41].[OH2:42].[OH2:43].[OH2:44].[OH:1][C:2]1([CH2:8][O:9][c:10]2[cH:11][c:12]([CH3:28])[c:13](-[c:17]3[cH:18][c:19]([C:24](=[O:25])[O:26][CH3:27])[cH:20][cH:21][c:22]3[CH3:23])[c:14]([CH3:16])[cH:15]2)[CH2:3][CH2:4][S:5][CH2:6][CH2:7]1.[S:45]([O-:46])([O-:47])(=[O:48])=[O:49]>>[OH:1][C:2]1([CH2:8][O:9][c:10]2[cH:11][c:12]([CH3:28])[c:13](-[c:17]3[cH:18][c:19]([CH2:24][OH:25])[cH:20][cH:21][c:22]3[CH3:23])[c:14]([CH3:16])[cH:15]2)[CH2:3][CH2:4][S:5][CH2:6][CH2:7]1
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 923Sodium Ion2×HCID 962Water10×HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×
HCID 23157321
methyl 4'-[(4-hydroxytetrahydro-2H-thiopyran-4-yl)methoxy]-2',6,6'-trimethylbiphenyl-3-carboxylate

Product 1

HCID 231574284-({[5'-(hydroxymethyl)-2,2',6-trimethylbiphenyl-4-yl]oxy}methyl)tetrahydro-2H-thiopyran-4-ol

Sources & evidence

ORD record
ord-7bf079c664b441db9be1b7c3729b566f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes