Valenene

ScientificNameLabel

Valenene
PHCD compound ID :	641
Chemical Names :	(+)-valencene , valencene , Valenene
Molecular Formula :	C15H24
Molecular Weight :	204.187801

More Details :

Names & Synonyms:	(3R,4aS,5R)-3-isopropenyl-4a,5-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene , (3R,4aS,5R)-4a,5-dimethyl-3-(1-methylethenyl)-2,3,4,5,6,7-hexahydro-1H-naphthalene , (3R,4aS,5R)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene
Smiles:	CC(=C)[C@@H]1CCC2=CCC[C@H]([C@@]2(C1)C)C
InChi :	InChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7,12-13H,1,5-6,8-10H2,2-4H3/t12-,13-,15+/m1/s1
InChi Key :	InChIKey=QEBNYNLSCGVZOH-NFAWXSAZSA-N
PubChem ID :	9855795

Rotatable bond count :	1	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	9.145579
Hydrogen bond donor count :	0	Electric dipole moment :	0.945
XLogP :	5.846	VDW volume :	238.010393
Molecular weight :	204.187801	HOMO-LUMO gap :	10.425000

Herb list :

- Eryngium billardieri - زول، بوقناق

Asafetida, Assa-foetida, Asafoetida - Ferula assa-foetida - آنغوزه، آنقوزه

Balanga, Bragon's head - Lallemantia iberica - بالنگوی شهری

Balm - Melissa officinalis - فرنجمشک، وارنگ بو، بارنگ بو

Balm mint - Melissa officinalis - فرنجمشک، وارنگ بو، بارنگ بو

Betony - Stachys lavandulifolia Vahl - چای کوهی، سنبله ای زیبا

Cinnamon - Cinnamomum zeylanicum - دارچین

Citron, Persian apple - Citrus medica - بالنگ، ترنج، بادرنگ

Clary, Clary sage - Salvia sclarea - مریم گلی

Elecampane, Inula - Inula helenium - زنجبیل شامی، مصفا

Fever few - Tanacetum parthenium - بابونه گاوی، مخلصه

Feverfew - Chrysanthemum parthenium - بابونه گاوی

Galbanum - Ferula gummosa - باريجه، قاسنی

Grape, Vine grape - Vitis vinifera - انگور

Hyssop - Hyssopus angustifolius - زوفا

Juniper - Juniperus communis L - پیرو، اربس

Kotschyam thyme - Thymus kotschyanus - آويشن

Lemongrass - Cymbopogon olivieri - پوتار، ناگرد، کاه مکی

Lesser galangal - Alpinia officinarum - خولنجان

Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش

Poleygermander - Teucrium polium - کلپوره، مریم نخودی

Saatar, Zataria - Zataria multiflora - آویشن شیرازی، ازکند

Tarragon, Wild dragon - Artemisia dracunculus - ترخون

Thyme, Garden thyme - Thymus vulgaris - آويشن باغی

Valerian - Valeriana officinalis - سنبل الطیب، والرین، سنبل الطیب اروپایی

Refrences & Litretures:


39. Journal:'Phytochemistry' Year:'2004' Volume:'65' Page:'2649' DOI:'10.1016/j.phytochem.2004.08.017' Title:'Vitis vinifera terpenoid cyclases: functional identi?cation of two sesquiterpene synthase cDNAs encoding (+)-valencene synthase and (-)-germacrene D synthase and expression of mono- and sesquiterpene synthases in grapevine ?owers and berries'
49. Journal:'Zahedan J Res Med Sci' Year:'2013' Volume:'15' Page:'8' DOI:'' Title:'Determining Chemical Composition and Antimicrobial Activity of Feverfew (Tanacetum parthenium L.) Essential Oil on Some Microbial Strains'
51. Journal:'Int. J. Agric. Biol' Year:'2010' Volume:'12' Page:'759' DOI:'' Title:'Chemical Composition and Antimicrobial Activity of Feverfew (Tanacetum parthenium) Essential Oil'
54. Journal:'Research Journal of Pharmacognosy' Year:'2014' Volume:'1' Page:'51' DOI:'' Title:'Assessment of chemical composition of essential oil of Ferula assa-foetida oleogum-resin from two different sites of Yazd province in center of Iran'
60. Journal:'Food Control' Year:'2008' Volume:'19' Page:'681' DOI:'10.1016/j.foodcont.2007.07.007' Title:'Antimicrobial activity and chemical composition of Thymus vulgaris, Thymus zygis and Thymus hyemalis essential oils'
70. Journal:'Journal of Pharmaceutical and Biomedical Analysis' Year:'2002' Volume:'29' Page:'691' DOI:'' Title:'GC/MS evaluation of thyme (Thymus vulgaris L.) oil composition and variations during the vegetative cycle'
72. Journal:'Industrial Crops and Products' Year:'2006' Volume:'24' Page:'253' DOI:'10.1016/j.indcrop.2006.06.011' Title:'Seasonal variation of Thymus hyemalis Lange and Spanish Thymus vulgaris L. essential oils composition'
77. Journal:'Annals of Biological Research' Year:'2012' Volume:'3' Page:'1443' DOI:'' Title:'Comparative Study of the Essential Oil Chemical Composition of Thymus Kotschyanus Boiss. & Hohen var. kotschyanus from Iran'
78. Journal:'Evidence-Based Complementary and Alternative Medicine' Year:'2012' Volume:'2012' Page:'1' DOI:'10.1155/2012/728065' Title:'Essential Oils Composition and Antioxidant Properties of Three Thymus Species'
85. Journal:'Food and Chemical Toxicology' Year:'2010' Volume:'48' Page:'1562' DOI:'10.1016/j.fct.2010.03.025' Title:'Chemical composition of essential oils in Zataria multi?ora Boiss. From different parts of Iran and their radical scavenging and antimicrobial activity'
105. Journal:'Natural Product Communications' Year:'2009' Volume:'4' Page:'859' DOI:'' Title:'Composition and Antibacterial Activity of Essential Oils from Leaf, Stem and Root of Chrysanthemum parthenium (L.) Bernh. from Iran'
114. Journal:'J. Mater. Environ. Sci' Year:'2015' Volume:'6' Page:'207' DOI:'' Title:'Chemical composition of the essential oils from leaves of Melissa officinalis extracted by hydrodistillation, steam distillation, organic solvent and microwave hydrodistillation'
116. Journal:'EXCLI Journal' Year:'2014' Volume:'13' Page:'772' DOI:'' Title:'CHEMICAL COMPOSITION AND ANTIMICROBIAL ACTIVITY OF THE ESSENTIAL OIL FROM LEAVES OF ALGERIAN MELISSA OFFICINALIS L'
125. Journal:'Chemistry of Natural Compounds' Year:'2008' Volume:'44' Page:'124' DOI:'' Title:'STUDY OF THE ESSENTIAL OIL VARIATION OF Ferula gummosa SAMPLES FROM IRAN'
131. Journal:'J. Sep. Sci' Year:'2009' Volume:'32' Page:'99' DOI:'10.1002/jssc.200800404' Title:'Essential oil composition of Citrusmedica L. Cv. Diamante (Diamante citron) determined after using different extractionmethods'
134. Journal:'Asian J. Chem' Year:'2012' Volume:'24' Page:'4817' DOI:'' Title:'Study of the Essential Oil Composition of Lallemantia iberica (M. Bieb.) Fisch. and C.A. Mey. (Lamiaceae) from Turkey'
212. Journal:'Iranian Journal of Pharmaceutical Research' Year:'2006' Volume:'1' Page:'65' DOI:'' Title:'Antimicrobial Activity and Composition of the Essential Oil of Cymbopogon Olivieri (Boiss.) Bor from Iran'
213. Journal:'Indian J Pharm Sci' Year:'2012' Volume:'74' Page:'356' DOI:'10.4103/0250474X.107071' Title:'Biochemical Activities of Iranian Cymbopogon olivieri (Boiss) Bor. Essential Oil'
214. Journal:'Flavour Fragr. J' Year:'2002' Volume:'17' Page:'272' DOI:'10.1002/ffj.1096' Title:'Volatile constituents of Cymbopogon olivieri (Boiss.) Bor from Iran'
215. Journal:'DARU Journal of Pharmaceutical Sciences' Year:'2003' Volume:'11' Page:'125' DOI:'' Title:'Chemical Constituents of Efficacy of Cymbopogon Olivieri (Boiss) Bar Essential Oil Against Malaria Vector , Anopheles Stepensi'
238. Journal:'Jundishapur J Microbiol' Year:'2013' Volume:'6' Page:'e7877' DOI:'10.5812/jjm.7877' Title:'The Evaluation of the Antibacterial and Antioxidant Activity of Tarragon (Artemisia dracunculus L.) Essential Oil and Its Chemical Composition'
282. Journal:'Intl J Farm & Alli Sci' Year:'2015' Volume:'4' Page:'197' DOI:'' Title:'Study of chemical composition and antibacterial effects of essential oils of Stachys lavandulifolia Vahl., Salvia verticillata L., and Tanacetum polycephalum Schultz-Bip. on some microbial lineages'
325. Journal:'J. Agric. Food Chem' Year:'2003' Volume:'51' Page:'4344' DOI:'10.1021/jf034169i' Title:'Volatile Constituents from Cinnamomum zeylanicum Fruit Stalks and Their Antioxidant Activities'
326. Journal:'Z. Naturforsch. C' Year:'2002' Volume:'57' Page:'990' DOI:'' Title:'Chemical Composition of Volatile Oil from Cinnamomum zeylanicum Buds'
386. Journal:'International Journal of Antimicrobial Agents' Year:'2008' Volume:'31' Page:'581' DOI:'10.1016/j.ijantimicag.2008.02.005' Title:'Antimicrobial activity of Inula helenium L. essential oil against Gram-positive and Gramnegative bacteria and Candida spp'
395. Journal:'Journal of Essential Oil Bearing Plants' Year:'2009' Volume:'12' Page:'111' DOI:'10.1080/0972060X.2009.10643700' Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Hyssopus angustifolius M.B'
451. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'397' DOI:'10.1080/10412905.2004.9698753' Title:'Essential Oil of Valeriana officinalis L. s.l. Growing Wild in Western Serbia'
597. Journal:'J. Agr. Sci. Tech' Year:'2015' Volume:'17' Page:'705' DOI:'' Title:'Morpho-chemical Diversity among Iranian Teucrium poliumL. (Lamiaceae) Populations in Fars Province'
675. Journal:'Food Control' Year:'2004' Volume:'15' Page:'549' DOI:'10.1016/j.foodcont.2003.08.009' Title:'Biological activities of the essential oils and methanol extract of Origanum vulgare ssp. vulgare in the Eastern Anatolia region of Turkey'
678. Journal:'Molecules' Year:'2013' Volume:'18' Page:'14948' DOI:'10.3390/molecules181214948' Title:'Chemical Composition and Biological Activity of Essential Oils of Origanum vulgare L. subsp. vulgare L. under Different Growth Conditions'
775. Journal:'J. BioSci. Biotech' Year:'2013' Volume:'2' Page:'39' DOI:'' Title:'Chemical composition and antifungal activity of essential oil of Salvia sclarea L. from Bulgaria against clinical isolates of Candida species'
790. Journal:'Journal of Essential Oil Research' Year:'2010' Volume:'22' Page:'521' DOI:'10.1080/10412905.2010.9700388' Title:'GC and GC/MS Analysis of the Volatile Constituents of the Oils of Alpinia galanga (L.) Willd and A. officinarum Hance Rhizomes'
865. Journal:'J. Agric. Food Chem' Year:'2005' Volume:'53' Page:'2630' DOI:'10.1021/jf048244g' Title:'Chemical Composition of Juniperus communis L. Fruits Supercritical CO2 Extracts: Dependence on Pressure and Extraction Time'
900. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'42' DOI:'10.1080/10412905.2004.9698648' Title:'Chemical Composition of the Essential Oil of Eryngium billardieri F. Delaroche from Iran'
919. Journal:'EXCLI Journal' Year:'2014' Volume:'13' Page:'772' DOI:'' Title:'Chemical composition and antimicrobial activity of the essential oil from leaves of Algerian Melissa officinalis L'