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Chemical structure of Pinocembrin 7-O-Beta-D-Glucoside

GC36922

Pinocembrin 7-O-Beta-D-Glucoside

Also known as (2S)-5-hydroxy-2-phenyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one

Pinocembrin 7-O-Beta-D-Glucoside (Pinocembrin 7-O-β-D-Glucoside) is is a flavanone that enhances lipid peroxidation

ChemicalCAS75829-43-5MW418.39FormulaC21H22O9
CAS number
75829-43-5
Molecular weight
418.39
Formula
C21H22O9
Solubility
DMSO ： 50 mg/mL (119·51 mM; Need ultrasonic)
InChIKey
GPGFGFUBECSNTG-SFTVRKLSSA-N
Catalogue number
GC36922
Brand
GLPBIO
Computed properties PubChem CID 46881227 · XLogP 0.9 · TPSA 146 Ų · H-bond donors 5
XLogP
0.9
TPSA
146 Ų
H-bond donors
5
H-bond acceptors
9
Rotatable bonds
4
Heavy atoms
30

SMILES C1[C@H](OC2=CC(=CC(=C2C1=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C4=CC=CC=C4

Computed descriptors from PubChem (CID 46881227), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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