Copaene

ScientificNameLabel

Copaene
PHCD compound ID :	427
Chemical Names :	Copaene , (-)-alpha-copaene , Alpha-Copaen , Alpha-capaene , Copaene
Molecular Formula :	C15H24
Molecular Weight :	204.187801

More Details :

Names & Synonyms:
Smiles:	CC([C@@H]1CC[C@]2([C@H]3[C@@H]1[C@@H]2C(=CC3)C)C)C
InChi :	InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12+,13+,14-,15-/m0/s1
InChi Key :	InChIKey=VLXDPFLIRFYIME-QRTUWBSPSA-N
PubChem ID :	19725

Rotatable bond count :	1	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	8.984749
Hydrogen bond donor count :	0	Electric dipole moment :	0.444
XLogP :	6.499	VDW volume :	228.290393
Molecular weight :	204.187801	HOMO-LUMO gap :	10.340000

Herb list :

Black cumin, Nutmeg flower, Fennel-flower, Roman coriander - Nigella sativa - سیاه دانه، شونیز

Black pepper - Piper nigrum - فلفل سیاه

Calamus - Acorus calamus - اگیر ترکی، اکیر ترکی

Carrot - Daucus carota - هویج

Church steeple - Agrimonia eupatoria - غافث

Clove - Eugenia caryophyllata - میخک هندی، میخک

Cumin - Cuminum cyminum - زیره سبز

Fennel - Foeniculum vulgare - رازیانه

Fig - Ficus carica - انجیر، شال انجیر

Forest pepper - Toddalia asiatica Lam - دهن باز دهن بسته

Grape, Vine grape - Vitis vinifera - انگور

Juniper - Juniperus communis L - پیرو، اربس

Lemon verbena, Lippia - Lippia citriodora - به ليمو

Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش

Oxtongue flower - Echium amoenum - گل گاو زبان

Parsley - Petroselinum crispum - جعفری

Perovskia - Perovskia abrotanoides - برازمبل

Sweet wormwood - Artemisia annua - گندواش، درمنه خزری، درمنه یکساله

Watercress - Nasturtium officinale - بولاغ اوتی، آب تره، علف چشمه، ترتیزک آبی

Ziziphora - Ziziphora tenuior - کاکوتی

Refrences & Litretures:


26. Journal:'Molecules' Year:'2013' Volume:'18' Page:'5684' DOI:'10.3390/molecules18055684' Title:'Identification of Insecticidal Constituents of the Essential Oil of Acorus calamus Rhizomes against Liposcelis bostrychophila Badonnel'
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'
38. Journal:'J. Agric. Food Chem' Year:'2009' Volume:'57' Page:'3818' DOI:'10.1021/jf803471n' Title:'Evolution of Volatile Compounds during the Development of Cabernet Sauvignon Grapes (Vitis vinifera L.)'
170. Journal:'J. Crop Prot' Year:'2012' Volume:'1' Page:'313' DOI:'' Title:'Chemical composition and insecticide activity of lemon verbena essential oil'
176. Journal:'Natural Product Research' Year:'2012' Volume:'26' Page:'109' DOI:'10.1080/14786419.2010.534998' Title:'Volatile constituents and antioxidant activity of flowers, stems and leaves of Nasturtium officinale R. Br'
350. Journal:'Flavour Fragr. J' Year:'2002' Volume:'17' Page:'345' DOI:'10.1002/ffj.1117' Title:'Comparison of essential oil composition of Iranian fennel (Foeniculum vulgare) obtained by supercritical carbon dioxide extraction and hydrodistillation methods'
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'
410. Journal:'Food Chemistry' Year:'2009' Volume:'115' Page:'1114' DOI:'10.1016/j.foodchem.2008.12.091' Title:'Extraction of Cuminum cyminum essential oil by combination technology of organic solvent with low boiling point and steam distillation'
456. Journal:'Journal of Essential Oil Bearing Plants' Year:'2013' Volume:'16' Page:'781' DOI:'10.1080/0972060X.2013.813275' Title:'Chemical Composition of the Essential Oil of Nigella sativa Seeds Extracted by Microwave Steam Distillation'
459. Journal:'Flavour Fragr. J' Year:'2007' Volume:'22' Page:'148' DOI:'10.1002/ffj.1773' Title:'Chemical composition of seed essential oils from Algerian Nigella sativa extracted by microwave and hydrodistillation'
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'
538. Journal:'Journal of Essential Oil Bearing Plants' Year:'2014' Volume:'17' Page:'1' DOI:'10.1080/0972060X.2013.831562' Title:'Antioxidant, Anti-inflammatory and Antinociceptive Properties of Black Pepper Essential Oil (Piper nigrum Linn)'
575. Journal:'J. Chin. Chem. Soc' Year:'2013' Volume:'60' Page:'649' DOI:'10.1002/jccs.201300133' Title:'Improvement of GC-MS Analysis of Shahrbabak Ziziphora tenuior Essential Oil by Using Multivariate Curve Resolution Approaches'
644. Journal:'Int. J. Biosci' Year:'2015' Volume:'6' Page:'156' DOI:'' Title:'Essential oil constituents and fatty acids in Echium amoenum grown wild in Iran'
660. Journal:'Journal of Chromatography A' Year:'2007' Volume:'1150' Page:'50' DOI:'10.1016/j.chroma.2006.08.080' Title:'Analysis of Artemisia annua L. volatile oil by comprehensive two-dimensional gas chromatography time-of-?ight mass spectrometry'
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'
705. Journal:'Phytother. Res' Year:'2007' Volume:'21' Page:'501' DOI:'10.1002/ptr.2124' Title:'The Chemical Composition and Biological Activity of Clove Essential Oil, Eugenia caryophyllata (Syzigium aromaticum L. Myrtaceae): A Short Review'
707. Journal:'Journal of Essential Oil Bearing Plants' Year:'2015' Volume:'18' Page:'967' DOI:'10.1080/0972060X.2014.884779' Title:'Chemical Composition, Antimicrobial andAntioxidant Activities of Eugenia caryophyllata Essential Oil'
735. Journal:'J. Mater. Environ. Sci' Year:'2015' Volume:'6' Page:'784' DOI:'' Title:'Chemical composition and antioxidant activity of the essential oil and the methanol extract of Algerian wild carrot Daucus carota L. ssp. carota. (L.) Thell'
766. Journal:'Journal of Herbal Drugs' Year:'2015' Volume:'6' Page:'59' DOI:'' Title:'Chemical composition of the volatile fraction of Perovskia abrotanoides and Nepeta glomerulosa growing wild in Iran by different extraction methods'
768. Journal:'J. Agric. Food Chem' Year:'1999' Volume:'47' Page:'3292' DOI:'10.1021/jf981159m' Title:'Compartive Study of Volatile Components and Fatty Acids of Plants and in Vitro Cultures of Parsley (Petroselinum crispum (Mill) Nym ex Hill)'
864. Journal:'CHEMISTRY &BIODIVERSITY' Year:'2015' Volume:'12' Page:'1706' DOI:'10.1002/cbdv.201400439' Title:'Chemical Composition of Juniperus communis L. Cone Essential Oil and Its Variability among Wild Populations in Kosovo'
867. Journal:'Parasitol Res' Year:'2013' Volume:'112' Page:'1197' DOI:'10.1007/s00436-012-3251-9' Title:'Essential oil composition and larvicidal activity of Toddalia asiatica roots against the mosquito Aedes albopictus (Diptera: Culicidae)'