Benzaldehyde → Flavanone

HRID 2146378Notes

Reaction equation

HRID 2146378 reaction equation
[CH3:42][CH2:43][OH:44].[CH:11](=[O:12])[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[Na+:19].[Na+:20].[OH2:21].[OH2:22].[OH2:23].[OH2:24].[OH2:25].[OH2:26].[OH2:27].[OH2:28].[OH2:45].[OH:1][c:2]1[c:3]([C:8]([CH3:9])=[O:10])[cH:4][cH:5][cH:6][cH:7]1.[OH:29][B:30]1[O:31][B-:32]2([OH:41])[O:33][B-:34]([OH:39])([O:35][B:36]([OH:38])[O:37]2)[O:40]1>>[O:1]1[c:2]2[c:3]([cH:4][cH:5][cH:6][cH:7]2)[C:8](=[O:10])[CH2:9][CH:11]1[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

7

Reactant 6

HCID 240BenzaldehydeHCID 702EthanolHCID 923Sodium ion2×HCID 962Water9×HCID 83752'-HydroxyacetophenoneHCID 15787661Tetraborate(2-)

Product 1

HCID 10251Flavanone

Sources & evidence

ORD record
ord-02747c88e64943049e15b54b0113ff8b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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