ChemicalBook--->CAS DataBase List--->14101-04-3

14101-04-3

14101-04-3 Structure

14101-04-3 Structure
IdentificationBack Directory
[Name]

FRANGULIN B
[CAS]

14101-04-3
[Synonyms]

FRANGULIN B
RAHMNOXANTHIN
Einecs 237-953-9
EModin 6-apioside
EMODIN-L-RHAMNOSIDE
EMODIN-6-O-APIOSIDE
EMODIN-6-(L)-O-APIOSIDE
6-o-(D-Apiofuranosyl)-1,6,8-trihydroxy-3-methylanthraquinone
3-(D-Apio-beta-D-furanosyloxy)-1,8-dihydroxy-6-methylanthraquinone
3-(D-apio-.betascsc.-furanosyloxy)-1,8-dihydroxy-6-methylanthraquinone
3-(D-Apio-β-D-furanosyloxy)-1,8-dihydroxy-6-methyl-9,10-anthracenedione
9,10-Anthracenedione, 3-(D-apio-β-D-furanosyloxy)-1,8-dihydroxy-6-methyl-
3-[[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)-2-oxolanyl]oxy]-1,8-dihydroxy-6-methylanthracene-9,10-dione
[EINECS(EC#)]

237-953-9
[Molecular Formula]

C20H18O9
[MDL Number]

MFCD00016362
[MOL File]

14101-04-3.mol
[Molecular Weight]

402.35
Chemical PropertiesBack Directory
[Melting point ]

196℃
[Boiling point ]

774.6±60.0 °C(Predicted)
[density ]

1.655±0.06 g/cm3 (20 ºC 760 Torr)
[storage temp. ]

2-8°C
[form ]

neat
[pka]

6.01±0.20(Predicted)
[InChI]

1S/C20H18O9/c1-8-2-10-14(12(22)3-8)17(25)15-11(16(10)24)4-9(5-13(15)23)29-19-18(26)20(27,6-21)7-28-19/h2-5,18-19,21-23,26-27H,6-7H2,1H3/t18-,19-,20+/m0/s1
[InChIKey]

AEQMIFRODRFTJF-SLFFLAALSA-N
[SMILES]

OC[C@]1(O)[C@@H](O)[C@@H](OC1)OC2=CC(O)=C3C(C(C(C=C(C)C=C4O)=C4C3=O)=O)=C2
[LogP]

3.660 (est)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

Frangulin B is an anthraquinone derivative that has been investigated for having anti-inflammatory effects, and as a natural product from Formosan plants acting as an Inhibitor of DNA Methyltransferase.
[Definition]

ChEBI: Frangulin B is an anthraquinone.
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