Betulonic acid

For Research Use Only.
Category
Terpenes
Cat.No.
NP6251
CAS
4481-62-3
Product Name
Betulonic acid
Structure

Product Details

Description
Betulonic acid isolated from the branch of Eucalyptus globulus Labill. It could be used as potential leads for the development of new type of anti-cancer agents.
Synonyms
Betulinonic acid;
IUPAC Name
(1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-5a,5b,8,8,11a-pentamethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid
Molecular Weight
454.7
Molecular Formula
C30H46O3
Canonical SMILES
CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)O
InChI
InChI=1S/C30H46O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h19-22,24H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,24+,27-,28+,29+,30-/m0/s1
Boiling Point
548.1±33.0 °C at 760 mmHg
Melting Point
264 °C
Flash Point
299.4±21.9 °C
Purity
97%
Density
1.1±0.1 g/cm3
Solubility
In Vitro:
DMSO : 6.67 mg/mL(14.67 mM;Need ultrasonic)
In Vivo:
1.Add each solvent one by one:10% DMSO >> 40%PEG300 >> 5%Tween-80 >> 45% saline
Solubility: ≥ 0.67 mg/mL (1.47 mM); Clear solution
2.Add each solvent one by one:10% DMSO >> 90%corn oil
Solubility: ≥ 0.67 mg/mL (1.47 mM); Clear solution
Appearance
Powder
Application
antiholestatic effects;
Storage
Powder:
-20°C 3 years
4°C 2 years
In solvent:
-80°C 6 months
-20°C 1 months
Color
White to Off-White
Form
Solid
HS Code
29389090
pKa
4.62±0.70(Predicted)
Safety Statements
24/25
Uses
(+)-Betulonic Acid shows potent cytotoxic activities against PC3, MGC-803, Bcap-37, and MCF-7 cell lines.
Vapor Pressure
0.0±3.2 mmHg at 25°C
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