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ChemicalBook--->CAS DataBase List--->6812-81-3

6812-81-3

6812-81-3 Structure

6812-81-3 Structure
IdentificationBack Directory
[Name]

roburic acid
[CAS]

6812-81-3
[Synonyms]

roburicaci
roburic acid
3,4-Secours-4(23),12-dien-3-oic acid
3,4-Secoursa-4(23),12-dien-3-oicacid(7CI)
Roburic acid, 98%, from Gentiana macrophylla Pall.
(1S,2S,4aR,4bS,6aR,9R,10S,10aR,12aR)-1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,12,12a-Hexadecahydro-1,4a,4b,6a,9,10-hexamethyl-2-(1-methylethenyl)-1-chrysenepropanoic acid
1-Chrysenepropanoic acid, 1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,12,12a-hexadecahydro-1,4a,4b,6a,9,10-hexamethyl-2-(1-methylethenyl)-, (1S,2S,4aR,4bS,6aR,9R,10S,10aR,12aR)-
[EINECS(EC#)]

211-708-6
[Molecular Formula]

C30H48O2
[MDL Number]

MFCD09953817
[MOL File]

6812-81-3.mol
[Molecular Weight]

440.7
Chemical PropertiesBack Directory
[Melting point ]

>181oC (dec.)
[Boiling point ]

528.5±49.0 °C(Predicted)
[density ]

1.02
[storage temp. ]

Hygroscopic, -20°C Freezer, Under inert atmosphere
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

4.73±0.10(Predicted)
[color ]

White to Off-White
Safety DataBack Directory
[Safety Statements ]

24/25
[HS Code ]

29163990
Hazard InformationBack Directory
[Uses]

Roburic Acid is a natural triterpene used in the treatment of anti-inflammatory preparations. Works through the inhibition of prostaglandin E2 Synthase-1.
[Definition]

ChEBI: Roburic acid is a tetracyclic triterpenoid with formula C30H40O2 that is isolated from the roots of Gentiana dahurica and Gentiana macrophylla. It has a role as a plant metabolite. It is a tetracyclic triterpenoid, an olefinic compound and a monocarboxylic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

roburic acid(6812-81-3)MS
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