ChemicalBook--->CAS DataBase List--->162857-78-5

162857-78-5

162857-78-5 Structure

162857-78-5 Structure
IdentificationBack Directory
[Name]

polygalaxanthone III
[CAS]

162857-78-5
[Synonyms]

Polygalaxanthone Ⅲ
polygalaxanthone III
Polygalaxanthone III, 98%, from Polygala tenuifolia Willd.
9H-Xanthen-9-one,2-(6-O-D-apio-b-D-furanosyl-b-D-glucopyranosyl)-1,3,6-trihydroxy-7-methoxy-
9H-Xanthen-9-one, 2-(6-O-D-apio-β-D-furanosyl-β-D-glucopyranosyl)-1,3,6-trihydroxy-7-methoxy-
2-(6-O-D-Apio-beta-D-furanosyl-beta-D-glucopyranosyl)-1,3,6-trihydroxy-7-methoxy-9H-xanthen-9-one
[Molecular Formula]

C25H28O15
[MDL Number]

MFCD32003794
[MOL File]

162857-78-5.mol
[Molecular Weight]

568.48
Chemical PropertiesBack Directory
[Melting point ]

180-183℃
[Boiling point ]

973.2±65.0 °C(Predicted)
[density ]

1.83
[storage temp. ]

4°C, protect from light
[solubility ]

DMSO : 250 mg/mL (439.77 mM; Need ultrasonic)
[form ]

Powder
[pka]

6.10±0.20(Predicted)
[color ]

Light yellow to yellow
[Major Application]

food and beverages
[InChIKey]

LLJUCXMVRPAONX-FPUOBQHINA-N
[SMILES]

OC1C([C@H]2[C@@H]([C@@H](O)[C@H](O)[C@@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)O2)O)=C(O)C=C2OC3=CC(O)=C(OC)C=C3C(=O)C=12 |&1:3,4,5,7,9,12,15,19,r|
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P264-P270-P301+P312+P330-P501
[Safety Statements ]

24/25
[WGK Germany ]

WGK 3
[HS Code ]

29143990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

It is a light yellow powder, soluble in organic solvents such as methanol, ethanol, and DMSO. It comes from the plant Polygala tenuifolia of the family Polygalaceae, also known as Polygala dasyphylla.
[Uses]

food and beverages
[IC 50]

CYP2
Spectrum DetailBack Directory
[Spectrum Detail]

polygalaxanthone III(162857-78-5)1HNMR
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