Alpha-bergamotene

ScientificNameLabel

Alpha-bergamotene
PHCD compound ID :	123
Chemical Names :	Alpha-bergamotene , Alpha-trans-Bergamotene , Alpha-berganotene , 2,6-Dimethyl-6-(4-methyl-3-pentenyl)-bicyclo[3.1.1]hept-2-ene , Alpha-transe-Bergamotene
Molecular Formula :	C15H24
Molecular Weight :	204.187801

More Details :

Names & Synonyms:	4,6-dimethyl-6-(4-methylpent-3-enyl)bicyclo[3.1.1]hept-3-ene
Smiles:	CC(=CCC[C@@]1(C)[C@H]2CC=C([C@@H]1C2)C)C
InChi :	InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6-7,13-14H,5,8-10H2,1-4H3/t13-,14-,15-/m0/s1
InChi Key :	InChIKey=YMBFCQPIMVLNIU-KKUMJFAQSA-N
PubChem ID :	86608

Rotatable bond count :	3	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	9.026020
Hydrogen bond donor count :	0	Electric dipole moment :	0.742
XLogP :	6.104	VDW volume :	238.010393
Molecular weight :	204.187801	HOMO-LUMO gap :	10.366000

Herb list :

- Eryngium campestre - زول، بوقناق

Balanga - Lallemantia royleana - بالنگوی شیرازی

Basil, Sweet basil - Ocimum basilicum - ریحان، تخم شربتی

Bay - Laurus nobilis - برگ بو

Black pepper - Piper nigrum - فلفل سیاه

Catnip, Catmint - Nepeta cataria - نعناع گربه‌ای، پونه‌سای گربه‌ای

Cinnamon - Cinnamomum zeylanicum - دارچین

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

Cumin - Cuminum cyminum - زیره سبز

Hop - Humulus lupulus - رازک

Kundur luban, Salai - Boswellia serrata - لیبان، کندر

Lavender - Lavandula angustifolia - اسطوخودوس

Lesser galangal - Alpinia officinarum - خولنجان

Lime - Citrus aurantifolia - لیمو عمانی، لیمو ترش

Maidenhair - Adiantum capillus-veneris - پرسياوش، پرسیاوشیان، پرسیاوشان

Mountain tobacco - Arnica montana - تنباکوی کوهی

Nutmeg - Myristica fragrans - جوز بویا

Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش

Persian yellow rose, Austrian briar - Rosa foetida - نسترن زرد، گل زرد، رز زرد ایرانی، رز معطر

Thyme, Garden thyme - Thymus vulgaris - آويشن باغی

Yarrow - Achillea millefolium - بومادران

Refrences & Litretures:


6. Journal:'Photochemistry and Photobiology' Year:'2014' Volume:'90' Page:'702' DOI:'10.1111/php.12229' Title:'Biochemical Composition and Antioxidant Properties of Lavandula angustifolia Miller Essential Oil are Shielded by Propolis Against UV Radiations'
9. Journal:'Food Chemistry' Year:'2009' Volume:'112' Page:'1072' DOI:'10.1016/j.foodchem.2008.07.015' Title:'Flavour compounds of Lavandula angustifolia L. to use in food manufacturing: Comparison of three different extraction methods'
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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'
181. Journal:'Flavour Fragr. J' Year:'2002' Volume:'17' Page:'165' DOI:'10.1002/ffj.1074' Title:'Essential oil composition of Achillea millefolium L. growing wild in Kashmir, India'
194. Journal:'J Nat Pharm Prod' Year:'2015' Volume:'10' Page:'e21968' DOI:'10.17795/jjnpp-21968' Title:'Essential Oil of Arial Parts of Adiantum capillus-veneris: Chemical Composition and Antioxidant Activity'
252. Journal:'Industrial Crops and Products' Year:'2012' Volume:'39' Page:'177' DOI:'10.1016/j.indcrop.2012.02.030' Title:'Rhizome and root yield of the cultivated Arnica montana L., chemical composition and histochemical localization of essential oil'
255. Journal:'chemija' Year:'2009' Volume:'20' Page:'190' DOI:'' Title:'Analysis of the chemical composition of fower essential oils from Arnica montana of Lithuanian origin'
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326. Journal:'Z. Naturforsch. C' Year:'2002' Volume:'57' Page:'990' DOI:'' Title:'Chemical Composition of Volatile Oil from Cinnamomum zeylanicum Buds'
340. Journal:'Food Anal. Methods' Year:'2014' Volume:'7' Page:'1433' DOI:'10.1007/s12161-013-9767-5' Title:'Comparative Gas Chromatographic–Mass Spectrometric Evaluation of Hop (Humulus lupulus L.) Essential Oils and Extracts Obtained Using Different Sample Preparation Methods'
341. Journal:'Journal of Brewing and Distilling' Year:'2011' Volume:'2' Page:'16' DOI:'' Title:'Volatile components of aroma hops (Humulus lupulus L.) commonly used in beer brewing'
365. Journal:'Food Chemistry' Year:'2008' Volume:'108' Page:'986' DOI:'10.1016/j.foodchem.2007.12.010' Title:'Chemical composition, antioxidant and antimicrobial activities of basil (Ocimum basilicum) essential oils depends on seasonal variations'
405. Journal:'FLAVOUR AND FRAGRANCE JOURNAL' Year:'2004' Volume:'19' Page:'311' DOI:'10.1002/ffj.1302' Title:'Chemical composition of the essential oil of Cuminum cyminum L. from China'
407. Journal:'Journal of Chromatography A' Year:'2006' Volume:'1102' Page:'11' DOI:'10.1016/j.chroma.2005.10.032' Title:'Improved solvent-free microwave extraction of essential oil from dried Cuminum cyminum L. and Zanthoxylum bungeanum Maxim'
528. Journal:'Journal of Ethnopharmacology' Year:'2009' Volume:'121' Page:'405' DOI:'10.1016/j.jep.2008.11.004' Title:'Chemical composition and mechanisms underlying the spasmolytic and bronchodilatory properties of the essential oil of Nepeta cataria L'
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'
627. Journal:'Chemistry of Natural Compounds' Year:'2015' Volume:'51' Page:'171' DOI:'10.1007/s10600-015-1233-8' Title:'CHEMICAL COMPOSITION OF THE ALIPHATIC COMPOUND-RICH ESSENTIAL OIL OF Rosa foetida FROM IRAN'
666. Journal:'Ann Chim' Year:'2007' Volume:'97' Page:'837' DOI:'' Title:'Chemical composition and antimicrobial activity of some oleogum resin essential oils from Boswellia spp. (Burseraceae)'
671. Journal:'J Sci Food Agric' Year:'2012' Volume:'92' Page:'2960' DOI:'10.1002/jsfa.5708' Title:'Evaluation of Citrus aurantifolia peel and leaves extracts for their chemical composition, antioxidant and anti-cholinesterase activities'
674. Journal:'Rev Bras Farmacogn' Year:'2014' Volume:'24' Page:'25' DOI:'10.1590/0102-695X2014241434' Title:'Analysis of essential oils of Origanum vulgare from six production areas of China and Pakistan'
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'
677. Journal:'J Sci Food Agric' Year:'2013' Volume:'93' Page:'2707' DOI:'10.1002/jsfa.6089' Title:'Chemical composition and bioactivity of different oregano (Origanum vulgare) extracts and essential oil'
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'
905. Journal:'Natural Product Communications' Year:'2008' Volume:'3' Page:'1121' DOI:'10.1177/1934578X0800300716' Title:'Essential Oil Composition of Eryngium campestre L. Growing in Different Soil Types. A Preliminary Study'