cholesteryl mercaptan

cholest-5-ene-3b-thiol

CAS: 1249-81-6 C27 H46 S MW: 402.72862000

Identification

Namecholesteryl mercaptan
IUPAC(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-thiol
CAS Number1249-81-6
EINECS215-003-4
FDA UNIISearch
Molecular FormulaC27 H46 S
Molecular Weight402.72862000
MDL NumberMFCD00003647
Nikkaji NumberJ39.842J

Regulatory

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 482.38 °C. @ 760.00 mm Hg (est)
Flash Point 435.00 °F. TCC ( 224.00 °C. ) (est)
logP (o/w) 11.330 (est)
Soluble in water, 6.361e-006 mg/L @ 25 °C (est)

No sensory data available

Safety Information

Preferred SDSView
Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryinformation only not used for fragrances or flavors
Recommendation for cholesteryl mercaptan usage levels up tonot for fragrance use.
Recommendation for cholesteryl mercaptan flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

not found in nature

Synonyms

(3b)- cholest-5-ene-3-thiol (3beta)- cholest-5-ene-3-thiol cholest-5-ene-3-thiol, (3b)- cholest-5-ene-3b-thiol cholest-5-ene-3beta-thiol (3S,8S,9S,10R,13R,14S,17R)-10,13- dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3-thiol thiocholesterol PubMed: Thioredoxin reductase reduces lipid hydroperoxides and spares alpha-tocopherol. PubMed: Toxicity of polyunsaturated fatty acid esters for human monocyte-macrophages: the anomalous behaviour of cholesteryl linolenate. PubMed: Phase behavior and crystalline structures of cholesteryl ester mixtures: a C-13 MASNMR study. PubMed: Cholesteryl ester cycle in cultured hepatoma cells. PubMed: beta-Carotene as a probe of lipid domains of reconstituted human plasma low-density lipoprotein: induced circular dichroism. PubMed: The ternary phase diagram of lecithin, cholesteryl linolenate and water: phase behavior and structure. PubMed: The binary phase diagram of lecithin and cholesteryl linolenate.