Alpha-Guaiene

ScientificNameLabel

Alpha-Guaiene
PHCD compound ID :	602
Chemical Names :	Alpha-Guaiene
Molecular Formula :	C15H24
Molecular Weight :	204.187801

More Details :

Names & Synonyms:	(1S,4S,7R)-7-isopropenyl-1,4-dimethyl-1,2,3,4,5,6,7,8-octahydroazulene , (1S,4S,7R)-1,4-dimethyl-7-(1-methylethenyl)-1,2,3,4,5,6,7,8-octahydroazulene , (1S,4S,7R)-1,4-dimethyl-7-prop-1-en-2-yl-1,2,3,4,5,6,7,8-octahydroazulene
Smiles:	CC(=C)[C@@H]1CC[C@@H](C2=C(C1)[C@@H](C)CC2)C
InChi :	InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+/m0/s1
InChi Key :	InChIKey=ADIDQIZBYUABQK-RWMBFGLXSA-N
PubChem ID :	5317844

Rotatable bond count :	1	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	8.779821
Hydrogen bond donor count :	0	Electric dipole moment :	0.973
XLogP :	5.387	VDW volume :	238.010393
Molecular weight :	204.187801	HOMO-LUMO gap :	10.027000

Herb list :

- Kelussia odoratissima - کلوس

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

Bay - Laurus nobilis - برگ بو

Black pepper - Piper nigrum - فلفل سیاه

Blue gum - Eucalyptus globulus - اکالیپتوس

Camphre - Cinnamomum camphora - کافور

Cardamon - Elettaria cardamomum - هل

Chio gum - Pistacia khinjuk - سقز، خنجک، خینجوک

Church steeple - Agrimonia eupatoria - غافث

Colt's foot, Horse hoof - Tussilago farfara - پای خر

Damask rose, Persian rose - Rosa damascena - گل محمدی، گل گلاب

Fig - Ficus carica - انجیر، شال انجیر

Galbanum - Ferula gummosa - باريجه، قاسنی

Garlic - Allium sativum - سیر

Ginger - Zingiber officinale - زنجبیل

Gum amoniacum, Ammoniac - Dorema ammoniacum - وشا، وشق، کماکندل، کندر

Hemp - Cannabis sativa - شاهدانه

Jerusalem oak - Chenopodium botrys - درمنه ترکی، سلمک اورشلیمی

Lesser galangal - Alpinia officinarum - خولنجان

Mugwort, Mugwood - Artemisia vulgaris - برنجاسف، درمنه معمولی

Rose Geranium - Pelargonium graveolens - شمعدانی معطر، شمعدانی قرمز

Strawberry - Fragaria vesca - توت فرنگی

Turpentine tree - Pistacia terebinthus - پسته کوهی

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

Violet - Viola odorata - بنفشه معطر، بنفشه

Wild celery, Celery - Apium graveolens - کرفس، کرفس وحشی

Refrences & Litretures:


35. Journal:'Food Chemistry' Year:'2010' Volume:'123' Page:'548' DOI:'10.1016/j.foodchem.2010.04.064' Title:'Volatile pro?ling of Ficus carica varieties by HS-SPME and GC–IT-MS'
37. Journal:'J. Agric. Food Chem' Year:'2010' Volume:'58' Page:'3393' DOI:'10.1021/jf9039759' Title:'Chemical Assessment and in Vitro Antioxidant Capacity of Ficus carica Latex'
55. Journal:'Food Chemistry' Year:'2013' Volume:'138' Page:'2180' DOI:'10.1016/j.foodchem.2012.11.131' Title:'Chemical composition, antioxidant and antimicrobial activities of essential oil obtained from Ferula assa-foetida oleo-gum-resin: Effect of collection time'
123. Journal:'Journal of Essential Oil Bearing Plants' Year:'2015' Volume:'18' Page:'1321' DOI:'10.1080/0972060X.2015.1024445' Title:'Chemical Composition of Essential Oils from Aerial Parts of Ferula gummosa (Apiaceae) in Jajarm Region, Iran Using Traditional Hydrodistillation and Solvent-Free Microwave Extraction Methods: A Comparative Approach'
141. Journal:'J Sci Food Agric' Year:'2014' Volume:'94' Page:'1197' DOI:'10.1002/jsfa.6397' Title:'Chemical composition and antioxidant properties of Laurus nobilis L. and Myrtus communis L. essential oils from Morocco and evaluation of their antimicrobial activity acting alone or in combined processes for food preservation'
143. Journal:'Journal of Stored Products Research' Year:'2012' Volume:'48' Page:'97' DOI:'10.1016/j.jspr.2011.10.003' Title:'Insecticidal activities of essential oils from leaves of Laurus nobilis L. from Tunisia, Algeria and Morocco, and comparative chemical composition'
144. Journal:'Tunisian Journal of Plant Protection' Year:'2011' Volume:'6' Page:'29' DOI:'' Title:'Composition and Repellent Efficacy of Essential Oil from Laurus nobilis against Adults of the Cigarette Beetle Lasioderma serricorne (Coleoptera: Anobiidae)'
155. Journal:'EJEAFChe' Year:'2012' Volume:'11' Page:'493' DOI:'' Title:'CHEMICAL COMPOSITION OF ESSENTIAL OIL OF ARTEMISIA VULGARIS FROM WEST AZERBAIJAN, IRAN'
161. Journal:'Archives of Applied Science Research' Year:'2011' Volume:'3' Page:'44' DOI:'' Title:'Biocontrol of Botrytis cinerea with essential oil and methanol extract of Viola odorata L. flowers'
190. Journal:'Journal of Essential Oil Bearing Plants' Year:'2011' Volume:'14' Page:'413' DOI:'' Title:'Volatile Oils of Flowers and Stems of Tussilago farfara L. from Lithuania'
261. Journal:'Herba Polonica' Year:'2009' Volume:'55' Page:'153' DOI:'' Title:'Contents and chemical composition of essential oils from wild strawberry (Fragaria vesca L.)'
383. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'186' DOI:'10.1080/10412905.2004' Title:'Chemical Composition of the Essential Oil of Zingiber officinale Roscoe L. from Cuba'
438. Journal:'Journal of Medicinal Plants' Year:'2010' Volume:'9' Page:'81' DOI:'' Title:'Antimicrobial Activity of the Leaves of Pistacia khinjuk'
439. Journal:'World Journal of Zoology' Year:'2009' Volume:'4' Page:'291' DOI:'' Title:'The Anthelmintic Effect of Pistacia khinjuk Against Protoscoleces of Echinococcus granulosus'
449. Journal:'Molecules' Year:'2010' Volume:'15' Page:'6411' DOI:'10.3390/molecules15096411' Title:'Chemical Analysis and Biological Activity of the Essential Oils of Two Valerianaceous Species from China: Nardostachys chinensis and Valeriana officinalis'
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'
453. Journal:'FLAVOUR AND FRAGRANCE JOURNAL' Year:'1997' Volume:'12' Page:'359' DOI:'' Title:'Composition of the Essential Oils from Underground Parts of Valeriana o?cinalis L. s.l. and Several Closely Related Taxa'
466. Journal:'Journal of Essential Oil Research' Year:'2014' Volume:'26' Page:'91' DOI:'10.1080/10412905.2013.868329' Title:'Composition of garlic essential oil (Allium sativum L.) as influenced by drying method'
487. Journal:'Fitoterapia' Year:'2010' Volume:'81' Page:'413' DOI:'10.1016/j.?tote.2009.11.010' Title:'Characterization and antimicrobial activity of essential oils of industrial hemp varieties (Cannabis sativa L.)'
491. Journal:'J. Nut. Prod' Year:'1996' Volume:'59' Page:'49' DOI:'' Title:'The Volatile Oil Composition of Fresh and Air-Dried Buds of Cannabis sativa'
536. Journal:'Journal of Analytical Methods in Chemistry' Year:'2013' Volume:'' Page:'246986' DOI:'10.1155/2013/246986' Title:'Comparative Analysis of the Volatile Components of Agrimonia eupatoria from Leaves and Roots by Gas Chromatography-Mass Spectrometry and Multivariate Curve Resolution'
539. Journal:'J. Med. Plants Res' Year:'2013' Volume:'7' Page:'2349' DOI:'10.5897/JMPR2013.4493' Title:'Correlation between chemical profiles of black pepper (Piper nigrum L.) var. Panniyur-1 collected from different locations'
541. Journal:'Journal of Essential Oil Research' Year:'2005' Volume:'17' Page:'153' DOI:'10.1080/10412905.2005.9698862' Title:'Studies on Essential Oil Composition of Cultivars of Black Pepper (Piper nigrum L.)—V'
563. Journal:'??????' Year:'2009' Volume:'31' Page:'77' DOI:'' Title:'Essential Oil Compositions and Bioactivities of the Various Pa r t s of Cinnamomum camphora Sieb. var. linaloolifera Fujuta'
633. Journal:'Journal of Biologically Active Products from Nature' Year:'2011' Volume:'1' Page:'19' DOI:'10.1080/22311866.2011.10719069' Title:'Chemical Composition and Antimicrobial Activity of Rosa damascena Mill Essential Oil'
634. Journal:'Chemistry of Natural Compounds' Year:'2009' Volume:'45' Page:'110' DOI:'' Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF Rosa damascena FROM TWO DIFFERENT LOCATIONS IN IRAN'
636. Journal:'Journal of Essential Oil Research' Year:'2013' Volume:'25' Page:'55' DOI:'10.1080/10412905.2012.751555' Title:'Comparison of microwave-assisted distillation and conventional hydrodistillation in the essential oil extraction of ?owers Rosa damascena Mill'
726. Journal:'WORLD JOURNAL OF PHARMACY AND PHARMACEUTICAL SCIENCES' Year:'2014' Volume:'3' Page:'1798' DOI:'' Title:'ANALYSIS OF VOLATILE OIL OF THE FRUITS OF ELETTARIA CARDAMOMUM (L.) MATON AND ITS ANTIMICROBIAL ACTIVITY'
744. Journal:'Research Journal of Pharmaceutical, Biological and Chemical Sciences' Year:'2013' Volume:'4' Page:'640' DOI:'' Title:'Chemical Composition of the Essential Oils from Flowers, Stems and Roots of Dorema ammoniacum D.Don from Iran'
758. Journal:'Chemistry of Natural Compounds' Year:'2010' Volume:'46' Page:'813' DOI:'10.1007/s10600-010-9754-7' Title:'CHEMICAL CHARACTERISTICS OF THE SEED OF IRANIAN ENDEMIC PLANT Kelussia odoratissima'
791. Journal:'African Journal of Biotechnology' Year:'2010' Volume:'9' Page:'4264' DOI:'' Title:'Chemical composition and antioxidant properties of the essential oil and methanol extracts of rhizoma Alpinia officinarum from China in vitro'
803. Journal:'Acta Sci. Pol. Hortorum Cultus' Year:'2016' Volume:'15' Page:'147' DOI:'' Title:'The chemical composition of the essential oil of leaf celery (Apium graveolens L. var. Secalinum Alef.) under the plants’ irrigation and harvesting method'
824. Journal:'Macedonian pharmaceutical bulletin' Year:'2014' Volume:'60' Page:'45' DOI:'' Title:'Chemical composition of Chenopodium botrys L. (Chenopodiaceae) essential oil'
847. Journal:'ORIENTAL JOURNAL OF CHEMISTRY' Year:'2016' Volume:'32' Page:'331' DOI:'10.13005/ojc/320137' Title:'A Comparative Study of the Chemical Composition of the Essential oil from Eucalyptus globulus Growing in Dehradun (india) and Around the World'
849. Journal:'Biological Forum – An International Journal' Year:'2015' Volume:'7' Page:'322' DOI:'' Title:'Chemical Composition of Eucalyptus globulus grown in Iran'
851. Journal:'J. Essent. Oil Res' Year:'1995' Volume:'7' Page:'147' DOI:'10.1080/10412905.1995.9698489' Title:'Chemical Composition of Eucalyptus globulus Oils from the Montenegro Coast and East Coast of Spain'
877. Journal:'Journal of Applied Pharmaceutical Science' Year:'2014' Volume:'4' Page:'1' DOI:'10.7324/JAPS.2014.40301' Title:'Chemical composition, antifungal and antioxidant activity of Pelargonium graveolens essential oil'
884. Journal:'Fitoterapia' Year:'2003' Volume:'74' Page:'170' DOI:'10.1016/S0367-326X(02)00318-0' Title:'Chemical composition and antifungal properties of essential oils of three Pistacia species'