Articles:
trans,trans,trans-16-hydroxy-2,6,10,14-tetramethyl-2,6,10,14-hexadecatetraen-4-one
Notes:
diterpene ketols from bifurcaria bifurcata; has antimicrobial activity.
| CAS Number: | 67880-32-4 |  3D/inchi
|
| Nikkaji Web: | J19.838B | |
| Beilstein Number: | 1968009 | |
| XlogP3-AA: | 5.50 (est) | |
| Molecular Weight: | 304.47344000 | |
| Formula: | C20 H32 O2 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: natural substances and extractives
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 437.00 to 438.00 °C. @ 760.00 mm Hg (est) |
| Flash Point: | 368.00 °F. TCC ( 186.70 °C. ) (est) |
| logP (o/w): | 4.521 (est) |
| Soluble in: | |
| water, 0.1552 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| None found |
Safety Information:
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
|
intraperitoneal-mouse LD50 50 mg/kg "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 12, Pg. 555, 1985. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | natural substances and extractives | ||
| Recommendation for eleganolone usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for eleganolone flavor usage levels up to: | |||
| not for flavor use. | |||
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 : | 6439034 |
| National Institute of Allergy and Infectious Diseases: | Data |
| (6E,10E,14E)-16-hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,14-tetraen-4-one | |
| Chemidplus: | 0067880324 |
References:
| (6E,10E,14E)-16-hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,14-tetraen-4-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 6439034 |
| Pubchem (sid): | 135259626 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| bifurcaria bifurcata Search PMC Picture | |
| cystoseira elegans Search Trop Picture |
Synonyms:
| 2,6,10,14- | hexadecatetraen-4-one, 16-hydroxy-2,6,10,14-tetramethyl-, (6E,10E,14E)- |
| 2,6,10,14- | hexadecatetraen-4-one, 16-hydroxy-2,6,10,14-tetramethyl-, (E,E,E)- |
| (E,E,E)-16- | hydroxy-2,6,10,14-tetramethyl-2,6,10,14-hexadecatetraen-4-one |
| trans,trans,trans-16- | hydroxy-2,6,10,14-tetramethyl-2,6,10,14-hexadecatetraen-4-one |
| (6E,10E,14E)-16- | hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,14-tetraen-4-one |