| Name: | [(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]phenanthren-3-yl] pentanoate |
| CAS Number: | 7726-03-6 |  3D/inchi
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| ECHA EINECS - REACH Pre-Reg: | 231-773-4 |
| FDA UNII: | Search |
| Nikkaji Web: | J150.864D |
| MDL: | MFCD00037706 |
| XlogP3-AA: | 10.50 (est) |
| Molecular Weight: | 470.78078000 |
| Formula: | C32 H54 O2 |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) |
Category:information only not used for fragrances or flavors
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Assay: | 95.00 to 100.00
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| Food Chemicals Codex Listed: | No |
| Boiling Point: | 530.00 °C. @ 760.00 mm Hg (est)
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| Flash Point: | 521.00 °F. TCC ( 271.80 °C. ) (est)
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| logP (o/w): | 12.070 (est) |
| Soluble in: |
| | water, 2.897e-007 mg/L @ 25 °C (est) |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). |
Cosmetic Information:
Suppliers:
Safety Information:
| Preferred SDS: View |
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| Hazards identification |
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| Classification of the substance or mixture |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
| None found. |
| GHS Label elements, including precautionary statements |
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| Pictogram | |
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| Hazard statement(s) |
| None found. |
| Precautionary statement(s) |
| None found. |
| Oral/Parenteral Toxicity: |
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Not determined
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| Dermal Toxicity: |
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Not determined
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| Inhalation Toxicity: |
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Not determined
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Safety in Use Information:
| Category: | | information only not used for fragrances or flavors |
| Recommendation for cholesteryl valerate usage levels up to: | | | not for fragrance use.
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| Recommendation for cholesteryl valerate flavor usage levels up to: |
| | not for flavor use.
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Safety References:
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :111329 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:3 |
| [(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]phenanthren-3-yl] pentanoate |
| Chemidplus:0007726036 |
References:
| | [(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]phenanthren-3-yl] pentanoate |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 111329 |
| Pubchem (sid): | 135068968 |
Other Information:
Potential Blenders and core components note
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| (3b)- | cholest-5-en-3-ol pentanoate | | (3b)- | cholest-5-en-3-yl valerate | | | cholest-5-en-3b-ol valerate | | | cholest-5-en-3beta-yl valerate | | 5- | cholesten-3b-ol valerate | | | cholesterol pentanoate | | | cholesterol valerate | | | cholesteryl N-valerate | | | cholesteryl pentanoate | | [(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]phenanthren-3-yl] pentanoate | | | pentanoic acid, (3b)-cholest-5-en-3-yl ester | | | valeric acid cholesteryl ester |
Articles:
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Cholesteryl pentanoate is an ester of cholesterol. Fatty acid esters of cholesterol constitute about two-thirds of the cholesterol in the plasma. Cholesterol is a sterol (a combination steroid and alcohol) and a lipid found in the cell membranes of all body tissues, and transported in the blood plasma of all animals. The accumulation of cholesterol esters in the arterial intima (the innermost layer of an artery, in direct contact with the flowing blood) is a characteristic feature of atherosclerosis. Atherosclerosis is a disease affecting arterial blood vessels. It is a chronic inflammatory response in the walls of arteries, in large part to the deposition of lipoproteins (plasma proteins that carry cholesterol and triglycerides). Cholesteryl esters, formed by the esterification of cholesterol with long-chain fatty acids, on one hand, are the means by which cholesterol is transported through the blood by lipoproteins, on the other, the way cholesterol itself can be accumulated in the cells. (PMID: 15939411) [HMDB]
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