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Roburic Acid

Names

[ CAS No. ]:
6812-81-3

[ Name ]:
Roburic Acid

[Synonym ]:
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)-
3-[(1S,2S,4aR,4bS,6aR,9R,10S,10aR,12aR)-1,4a,4b,6a,9,10-Hexamethyl-2-(prop-1-en-2-yl)-1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,12,12a-hexadecahydrochrysen-1-yl]propanoic acid
Roburinsaeure
3-[(1S,2S,4aR,4bS,6aR,9R,10S,10aR,12aR)-2-Isopropenyl-1,4a,4b,6a,9,10-hexamethyl-1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,12,12a-hexadecahydro-1-chrysenyl]propanoic acid
Roburic Acid
Robursaeure

Biological Activity

[Description]:

Roburic acid, a tetracyclic triterpenoid found in Gentiana macrophylla, acts as an inhibitor of COX, with IC50s of 5 and 9 μM for COX-1 and COX-2, respectively[1].

[Related Catalog]:

Signaling Pathways >> Immunology/Inflammation >> COX

[Target]

COX-1:5 μM (IC50)

COX-2:9 μM (IC50)


[References]

[1]. Cao H, et al. Discovery of cyclooxygenase inhibitors from medicinal plants used to treat inflammation. Pharmacol Res. 2010 Jun;61(6):519-24.

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
528.5±49.0 °C at 760 mmHg

[ Molecular Formula ]:
C30H48O2

[ Molecular Weight ]:
440.701

[ Flash Point ]:
424.9±25.0 °C

[ Exact Mass ]:
440.365417

[ PSA ]:
37.30000

[ LogP ]:
11.09

[ Vapour Pressure ]:
0.0±3.0 mmHg at 25°C

[ Index of Refraction ]:
1.532

Safety Information

[ Safety Phrases ]:
24/25

Synthetic Route


Related Compounds