Guggulsterone | CAS No. 95975-55-6

Guggulsterone

Basic Information

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CAS Number

95975-55-6

Molecular Formula

C21H28O2

Molecular Weight

312.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Physical State

Powder

Solubility

DMSO: 5 mg/mL

SMILES

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CC=C1C(=O)CC2C1(CCC3C2CCC4=CC(=O)CCC34C)C

InChI

InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1

InChIKey

WDXRGPWQVHZTQJ-NRJJLHBYSA-N

LogP

4.643600000000005

Topological Polar Surface Area

34.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

640

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

(Z)-Guggulsterone
(17Z)-Pregna-4,17(20)-diene-3,16-dione
Guggulsterone
Guggulsterone E&Z
(4,17(20)t)-Pregnadien-3,16-dion
4,17(20)-Z-pregnadiene-3,16-dione
CIS GUGGULSTERONE
E-guggulsterone
GUGGULESTERONE Z
GUGGULSTERONE (Z FORM)
GUGGULSTERONE Z
Guggulsterone Z (25 mg)
GUGGULSTERONE Z(P)
GUGULSTERONE
Neuropeptide W-23 (human)
Z-Gugglesterone
Z-Guggulsteron
Z-guggulsterone
Guggulsterones E&Z
B6925
(8S,9R,10R,13R,14S,17E)-17-Ethylidene-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]p
Guglip
Gugulipid
Z/E-Guggulsterone
Guggulsterone Z, United States Pharmacopeia (USP) Reference Standard
Guggulsterone; Guglip; Gugulipid;
(1Z,3aS,3bR,9aR,9bS,11aS)-1-ethylidene-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-2,7-dione
(1S,2R,10R,11S,14Z,15S)-14-ethylidene-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-ene-5,13-dione
4,17(20)-trans-Pregnadiene-3,16-dione
Guggulsterones Z
Z-Guggulsterone

MDL Number

MFCD01310757

FAQ

What are the physical and chemical properties of Guggulsterone (CAS: 95975-55-6)?

Guggulsterone (CAS: 95975-55-6) is a crystalline compound with a molecular weight of approximately 344.41 g/mol. It has a low solubility in water but is soluble in organic solvents like ethanol and acetone. Guggulsterone is moderately reactive, particularly in the presence of strong acids or bases. It is used in applications requiring its unique biological and chemical properties.

How is Guggulsterone (CAS: 95975-55-6) typically synthesized?

Guggulsterone (CAS: 95975-55-6) is typically synthesized via chemical derivatization of guggul resin, a natural product. The synthesis involves reactions such as esterification and hydrogenation. Commonly used catalysts include palladium on carbon, and the process yields up to 80% pure Guggulsterone, with selectivity towards the desired stereoisomer.

What industries use Guggulsterone (CAS: 95975-55-6)?

Guggulsterone (CAS: 95975-55-6) finds applications in the pharmaceutical industry, where it is used as an anti-inflammatory and anti-atherosclerotic agent. It is also utilized in the cosmetic industry for its skin health benefits and in the food industry as a potential flavor enhancer. Additionally, it is explored in the polymer and sensor industries for its unique properties.

What precautions should be taken when handling Guggulsterone (CAS: 95975-55-6)?

When handling Guggulsterone (CAS: 95975-55-6), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to minimize exposure. Spills should be handled with caution, using appropriate absorbents, and the material safety data sheet (MSDS) should be consulted for detailed spill procedures.