CAS 20817-72-5|Stigmastadienone

Introduction:Basic information about CAS 20817-72-5|Stigmastadienone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameStigmastadienone
CAS Number20817-72-5Molecular Weight410.67500
Density/Boiling Point/
Molecular FormulaC29H46OMelting Point/
MSDS/Flash Point/

Names

Namestigmast-4,22-dien-3-one
SynonymMore Synonyms

Stigmastadienone BiologicalActivity

DescriptionStigmasta-4,22-dien-3-one is an antitubercular agent. Stigmasta-4,22-dien-3-one shows cytotoxicity against human HT1080 tumoral cell line with an IC50 of 0.3 mM[1][2].
Related CatalogResearch Areas >>CancerResearch Areas >>InfectionSignaling Pathways >>Anti-infection >>Bacterial
References

[1]. Saludes JP, et al. Antitubercular constituents from the hexane fraction of Morinda citrifolia Linn. (Rubiaceae). Phytother Res. 2002 Nov;16(7):683-5.

[2]. Sandjo L P, et al. Cytotoxic effect of some pentacyclic triterpenes and hemisynthetic derivatives of stigmasterol. Chemistry of Natural Compounds, 2011, 47(5): 731-734.

Chemical & Physical Properties

Molecular FormulaC29H46O
Molecular Weight410.67500
Exact Mass410.35500
PSA17.07000
LogP8.00900
InChIKeyMKGZDUKUQPPHFM-LPJPOILFSA-N
SMILESCCC(C=CC(C)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)C(C)C
Storage condition-20°C

Synonyms

4,22-stigmastadien-3-one
Stigmast-4,22-dien-3-one
stigmasta-4,22-dien-3-one
4,22-cholestadiene-24β-ethyl-3-one
Δ4,22-stigmasten-3-one
(8S,9S,10R,13R,14S,17R)-17-((Z)-(1R,4S)-4-Ethyl-1,5-dimethyl-hex-2-enyl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthren-3-one
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