Sodium ion → {1-benzyl-3-[(3-([2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}-4-methoxybenzyl)oxy]-1H-pyrazol-4-yl}methanol

HRID 2134524Notes

Reaction equation

HRID 2134524 reaction equation
[Al+3:42].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][c:10]([O:18][CH2:19][c:20]2[cH:21][c:22]([O:28][CH2:29][c:30]3[n:31][c:32](-[c:36]4[o:37][cH:38][cH:39][cH:40]4)[o:33][c:34]3[CH3:35])[c:23]([O:26][CH3:27])[cH:24][cH:25]2)[c:11]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[cH:12]1.[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[H-:41].[H-:44].[H-:45].[H-:46].[Li+:43].[Na+:62].[Na+:63].[O:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1.[OH2:47].[OH2:48].[OH2:49].[OH2:50].[OH2:51].[OH2:52].[OH2:53].[OH2:54].[OH2:55].[OH2:56].[S:57]([O-:58])([O-:59])(=[O:60])=[O:61]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][c:10]([O:18][CH2:19][c:20]2[cH:21][c:22]([O:28][CH2:29][c:30]3[n:31][c:32](-[c:36]4[o:37][cH:38][cH:39][cH:40]4)[o:33][c:34]3[CH3:35])[c:23]([O:26][CH3:27])[cH:24][cH:25]2)[c:11]([CH2:13][OH:14])[cH:12]1

Participants

10

Reactant 9

HCID 923Sodium ion2×HCID 962Water10×HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 69218283ethyl 1-benzyl-3-[(3-{[2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}-4-methoxybenzyl)oxy]-1H-pyrazole-4-carboxylate

Product 1

HCID 69216951{1-benzyl-3-[(3-([2-(2-furyl)-5-methyl-1,3-oxazol-4-yl]methoxy}-4-methoxybenzyl)oxy]-1H-pyrazol-4-yl}methanol

Sources & evidence

ORD record
ord-b35c602fc5364dc0860eb643fd41eada
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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