| Identification | Back 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 Properties | Back 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 | [Stability:]
Hygroscopic | [Major Application]
food and beverages | [InChIKey]
RPPYCVULPFKBOG-CSHKLQQTSA-N | [SMILES]
OC(=O)CC[C@@]1([C@@H]2[C@]([C@@]3(CC[C@@]4([C@@H]([C@H]([C@@H](CC4)C)C)C3=CC2)C)C)(CC[C@H]1C(=C)C)C)C |
| Hazard Information | Back Directory | [Chemical Properties]
White crystalline powder, easily soluble in methanol and chloroform, derived from Gentiana macrophylla. | [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. | [IC 50]
COX-1: 5 μM (IC50); COX-2: 9 μM (IC50) |
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SiChuan HHTC Biological Technology Co., LTD Gold
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