CAS 20137-37-5|Rutundic acid

Introduction：Basic information about CAS 20137-37-5|Rutundic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Rutundic acid BiologicalActivity
3. Chemical & Physical Properties
4. Synonyms

Common Name	Rutundic acid
CAS Number	20137-37-5	Molecular Weight	488.699
Density	1.2±0.1 g/cm3	Boiling Point	622.8±55.0 °C at 760 mmHg
Molecular Formula	C₃₀H₄₈O₅	Melting Point	272-274℃
MSDS	/	Flash Point	344.5±28.0 °C

Names

Name	(1R,2R,4aS,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-1,10-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
Synonym	More Synonyms

Rutundic acid BiologicalActivity

Description	Rotundic acid, a triterpenoid obtained from I. rotunda, induces DNA damage and cell apoptosis in hepatocellular carcinoma through AKT/mTOR and MAPK Pathways. Rotundic acid possesses anti-inflammatory and cardio-protective abilities[1].
Related Catalog	Signaling Pathways >>PI3K/Akt/mTOR >>mTORSignaling Pathways >>Apoptosis >>ApoptosisResearch Areas >>CancerSignaling Pathways >>PI3K/Akt/mTOR >>Akt
Target	Akt mTOR p38 MAPK
References	[1]. Roy G, et al. Rotundic Acid Induces DNA Damage and Cell Death in Hepatocellular Carcinoma Through AKT/mTOR and MAPK Pathways. Front Oncol. 2019 Jun 26;9:545.

Chemical & Physical Properties

Density	1.2±0.1 g/cm3
Boiling Point	622.8±55.0 °C at 760 mmHg
Melting Point	272-274℃
Molecular Formula	C₃₀H₄₈O₅
Molecular Weight	488.699
Flash Point	344.5±28.0 °C
Exact Mass	488.350189
PSA	97.99000
LogP	5.75
Vapour Pressure	0.0±4.1 mmHg at 25°C
Index of Refraction	1.581
InChIKey	YLHQFGOOMKJFLP-LTFXOGOQSA-N
SMILES	CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1(C)O
Storage condition	-20℃

Synonyms

(3β)-3,19,23-Trihydroxyurs-12-en-28-oic acid

Rotundic acid

Urs-12-en-28-oic acid, 3,19,23-trihydroxy-, (3β)-

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