beta-humulene

(1Z,5E)-1,4,4-trimethyl-8-methylidenecycloundeca-1,5-diene

CAS: 116-04-1 C15 H24 MW: 204.35628000

Identification

Namebeta-humulene
IUPAC(1Z,5E)-1,4,4-trimethyl-8-methylidenecycloundeca-1,5-diene
CAS Number116-04-1
FDA UNIIKK0W1K5Z3S
Molecular FormulaC15 H24
Molecular Weight204.35628000
Beilstein3238625

Regulatory

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 272.00 to 273.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure 0.010000 mmHg @ 25.00 °C. (est)
Flash Point 227.00 °F. TCC ( 108.40 °C. ) (est)
logP (o/w) 6.571 (est)
Soluble in water, 0.01396 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

Categorynatural substances and extractives
Recommendation for beta-humulene usage levels up tonot for fragrance use.
Recommendation for beta-humulene flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

achillea distans willd. var. distans allspice fruit artemisia xerophytica celery seed copaifera langsdorfii desf. guava fruit hop larix sibirica lemon oil lippia alba spearmint leaf

Synonyms

(1Z,5E)-1,4,4- trimethyl-8-methylidenecycloundeca-1,5-diene PubMed: Composition of essential oils of four Hedychium species from Vietnam. PubMed: Sterhirsutins A and B, Two New Heterodimeric Sesquiterpenes with a New Skeleton from the Culture of Stereum hirsutum Collected in Tibet Plateau. PubMed: Antioxidant activity of Ziziphora tenuoir methanolic extracts and comparison of the essential oil in two stages of growth. PubMed: Chemotype diversity of indigenous Dalmatian sage (Salvia officinalis L.) populations in Montenegro. PubMed: Chemical composition of the essential oil from the leaves of Carapa guianensis collected from Venezuelan Guayana and the antimicrobial activity of the oil and crude extracts. PubMed: Hepatoprotection of sesquiterpenoids: a quantitative structure-activity relationship (QSAR) approach. PubMed: Development of a high performance liquid chromatography method for quantification of isomers β-caryophyllene and α-humulene in copaiba oleoresin using the Box-Behnken design. PubMed: Tomato yellow leaf curl virus alters the host preferences of its vector Bemisia tabaci. PubMed: Chemical composition and antimicrobial activity of three essential oils from Curcuma wenyujin. PubMed: Essential oils from the leaves of six medicinal plants of Nigeria. PubMed: Isolation and biomimetic synthesis of (±)-guajadial B, a novel meroterpenoid from Psidium guajava. PubMed: Volatile emissions of scented Alstroemeria genotypes are dominated by terpenes, and a myrcene synthase gene is highly expressed in scented Alstroemeria flowers. PubMed: Chemical diversity in Mentha spicata: antioxidant and potato sprout inhibition activity of its essential oils. PubMed: Accumulation of phenylpropanoid and sesquiterpenoid volatiles in male rectal pheromonal glands of the guava fruit fly, Bactrocera correcta. PubMed: Chemical analysis and biological activity of the essential oils of two valerianaceous species from China: Nardostachys chinensis and Valeriana officinalis. PubMed: Chemical composition and biological activities of Santiria trimera (Burseraceae) essential oils from Gabon. PubMed: Birch (Betula spp.) leaves adsorb and re-release volatiles specific to neighbouring plants--a mechanism for associational herbivore resistance? PubMed: [Studies on chemical constituents in fruit of Alpinia oxyphylla]. PubMed: Preventive and therapeutic anti-inflammatory properties of the sesquiterpene alpha-humulene in experimental airways allergic inflammation. PubMed: Suppression of lipopolysaccharide-stimulated inducible nitric oxide synthase (iNOS) expression by a novel humulene derivative in macrophage cells. PubMed: Cytotoxic activity of essential oils from labiatae and lauraceae families against in vitro human tumor models. PubMed: Effect of two active compounds obtained from the essential oil of Cordia verbenacea on the acute inflammatory responses elicited by LPS in the rat paw. PubMed: Zerumbone suppresses phorbol ester-induced expression of multiple scavenger receptor genes in THP-1 human monocytic cells. PubMed: Analysis of atmospheric sesquiterpenes: sampling losses and mitigation of ozone interferences. PubMed: Zerumbone abolishes NF-kappaB and IkappaBalpha kinase activation leading to suppression of antiapoptotic and metastatic gene expression, upregulation of apoptosis, and downregulation of invasion. PubMed: Gastric antiulcer and anti-inflammatory activities of the essential oil from Casearia sylvestris Sw. PubMed: Biomimetic cycloaddition approach to tropolone natural products via a tropolone ortho-quinone methide. PubMed: Genetic control and evolution of sesquiterpene biosynthesis in Lycopersicon esculentum and L. hirsutum. PubMed: Antifungal activity of volatile constituents of Eugenia dysenterica leaf oil. PubMed: Studies toward the biomimetic synthesis of tropolone natural products via a hetero Diels-Alder reaction. PubMed: Germacrene C synthase from Lycopersicon esculentum cv. VFNT cherry tomato: cDNA isolation, characterization, and bacterial expression of the multiple product sesquiterpene cyclase.