ChemicalBook--->CAS DataBase List--->4839-60-5

4839-60-5

4839-60-5 Structure

4839-60-5 Structure
IdentificationBack Directory
[Name]

Chrysophanein
[CAS]

4839-60-5
[Synonyms]

PulMatin
Chrysophaniin
Chrysophanein
Chrysophanol 1-glucoside
Chrysophanol 1-O-glucoside
Chrysophanol-1-O-β-D-glucoside
Chrysophanol 1-β-D-glucopyranoside
Chrysophanol 1-O-beta-D-glucopyranoside
Chrysophanein, Chrysophanol-1-O-glucoside
1-(β-D-Glucopyranosyloxy)-3-methyl-8-hydroxy-9,10-anthraquinone
1-(β-D-Glucopyranosyloxy)-8-hydroxy-3-methyl-9,10-anthracenedione
9,10-Anthracenedione, 1-(β-D-glucopyranosyloxy)-8-hydroxy-3-methyl-
[Molecular Formula]

C21H20O9
[MDL Number]

MFCD28964227
[MOL File]

4839-60-5.mol
[Molecular Weight]

416.38
Chemical PropertiesBack Directory
[Melting point ]

245-246℃
[Boiling point ]

765.8±60.0 °C(Predicted)
[density ]

1.596±0.06 g/cm3 (20 ºC 760 Torr)
[form ]

Solid
[pka]

6.71±0.20(Predicted)
[color ]

Light yellow to orange
[InChIKey]

QKPDYSSHOSPOKH-FMQABLMVNA-N
[SMILES]

O([C@H]1[C@@H]([C@@H](O)[C@H](O)[C@@H](CO)O1)O)C1=CC(C)=CC2C(C3=CC=CC(O)=C3C(=O)C1=2)=O |&1:1,2,3,5,7,r|
Hazard InformationBack Directory
[Uses]

Chrysophanein is a chrysophanol glycoside from leaves and roots of Aloe hijazensis. Chrysophanein shows a moderate cytotoxic activity against several carcinoma cells lines[1].
[Definition]

ChEBI: Chrysophanein is an anthraquinone.
[References]

[1] Abd-Alla, H. I.,et al. New bioactive compounds from Aloe hijazensis. Natural Product Research,2009,23(11), 1035–1049.
Spectrum DetailBack Directory
[Spectrum Detail]

Chrysophanein(4839-60-5)1HNMR
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