(1E,6E)-gamma-humulene
1,6-cycloundecadiene, 1,8,8-trimethyl-5-methylene-, (E,E)-
 
Notes:
None found
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CAS Number: 26259-79-0Picture of molecule3D/inchi
MDL: MFCD00210052
XlogP3-AA: 5.00 (est)
Molecular Weight: 204.35628000
Formula: C15 H24
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Category: natural substances and extractives
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 276.00 °C. @ 760.00 mm Hg (est)
Flash Point: 230.00 °F. TCC ( 110.10 °C. ) (est)
logP (o/w): 6.990 (est)
Soluble in:
 water, 0.01196 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: natural substances and extractives
Recommendation for (1E,6E)-gamma-humulene usage levels up to:
 not for fragrance use.
 
Recommendation for (1E,6E)-gamma-humulene flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
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EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6365330
National Institute of Allergy and Infectious Diseases: Data
 (1E,6E)-1,8,8-trimethyl-5-methylidenecycloundeca-1,6-diene
Chemidplus: 0026259790
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References:
 (1E,6E)-1,8,8-trimethyl-5-methylidenecycloundeca-1,6-diene
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 6365330
Pubchem (sid): 135205900
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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
CHEBI: View
KEGG (GenomeNet): C16829
HMDB (The Human Metabolome Database): Search
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 found in nature
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Synonyms:
1,6-cycloundecadiene, 1,8,8-trimethyl-5-methylene-, (E,E)-
(1E,6E)-humula-1(11),4(13),5-triene
(E,E)-1,8,8-trimethyl-5-methylene-1,6-cycloundecadiene
(1E,6E)-1,8,8-trimethyl-5-methylidenecycloundeca-1,6-diene
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Articles:
PubMed: Rational engineering of plasticity residues of sesquiterpene synthases from Artemisia annua: product specificity and catalytic efficiency.
PubMed: Activations of Both Extrinsic and Intrinsic Pathways in HCT 116 Human Colorectal Cancer Cells Contribute to Apoptosis through p53-Mediated ATM/Fas Signaling by Emilia sonchifolia Extract, a Folklore Medicinal Plant.
PubMed: Death receptor 5-mediated TNFR family signaling pathways modulate γ-humulene-induced apoptosis in human colorectal cancer HT29 cells.
PubMed: Unearthing the roots of the terpenome.
PubMed: How to evolve a silk purse from a sow's ear.
PubMed: Designed divergent evolution of enzyme function.
PubMed: Alteration of product formation by directed mutagenesis and truncation of the multiple-product sesquiterpene synthases delta-selinene synthase and gamma-humulene synthase.
PubMed: Molecular cloning, expression, and characterization of amorpha-4,11-diene synthase, a key enzyme of artemisinin biosynthesis in Artemisia annua L.
PubMed: Sesquiterpene synthases from grand fir (Abies grandis). Comparison of constitutive and wound-induced activities, and cDNA isolation, characterization, and bacterial expression of delta-selinene synthase and gamma-humulene synthase.
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