Sodium ion → HCID 69420168, compound

HRID 197204Notes

Reaction equation

HRID 197204 reaction equation
[Al+3:2].[CH3:7][c:8]1[c:9]([CH2:19][O:20][c:21]2[cH:22][cH:23][c:24]([CH2:27][n:28]3[n:29][c:30](-[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[c:31]([C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:32]3)[cH:25][n:26]2)[n:10][c:11](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[o:12]1.[H-:1].[H-:4].[H-:5].[H-:6].[Li+:3].[Na+:59].[Na+:60].[O:61]1[CH2:62][CH2:63][CH2:64][CH2:65]1.[OH2:44].[OH2:45].[OH2:46].[OH2:47].[OH2:48].[OH2:49].[OH2:50].[OH2:51].[OH2:52].[OH2:53].[S:54]([O-:55])([O-:56])(=[O:57])=[O:58]>>[CH3:7][c:8]1[c:9]([CH2:19][O:20][c:21]2[cH:22][cH:23][c:24]([CH2:27][n:28]3[n:29][c:30](-[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[c:31]([CH2:33][OH:34])[cH:32]3)[cH:25][n:26]2)[n:10][c:11](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[o:12]1

Participants

9

Reactant 8

HCID 923Sodium ion2×HCID 962Water10×HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 69422789ethyl 1-[6-(5-methyl-2-phenyl-4-oxazolylmethoxy)-3-pyridylmethyl]-3-phenyl-1H-pyrazole-4-carboxylate

Product 1

HCID 69420168HCID 69420168, compound

Sources & evidence

ORD record
ord-c675dddf0fa94966a0df48eecefca722
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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