a-Calacorene

ScientificNameLabel

a-Calacorene
PHCD compound ID :	304
Chemical Names :	Alpha-Calacorene , a-Calacorene , Alpha-calacorone , Calacorene
Molecular Formula :	C15H20
Molecular Weight :	200.156501

More Details :

Names & Synonyms:	(1S)-1-isopropyl-4,7-dimethyl-1,2-dihydronaphthalene , (1S)-4,7-dimethyl-1-propan-2-yl-1,2-dihydronaphthalene
Smiles:	CC([C@@H]1CC=C(c2c1cc(C)cc2)C)C
InChi :	InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5-7,9-10,13H,8H2,1-4H3/t13-/m0/s1
InChi Key :	InChIKey=CUUMXRBKJIDIAY-ZDUSSCGKSA-N
PubChem ID :	12302243

Rotatable bond count :	1	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	8.494107
Hydrogen bond donor count :	0	Electric dipole moment :	0.452
XLogP :	5.668	VDW volume :	221.837476
Molecular weight :	200.156501	HOMO-LUMO gap :	8.624000

Herb list :

- Ephedra nebrodensis - ریش بز، ارمک

- Eryngium campestre - زول، بوقناق

- Salvia hydrangea DC. Ex Benth - مریم گلی تماشائی، عقربان، گل ارونه

Absinthium, Wormwood - Artemisia absinthium - افسنطین

Borage, Ox-tongue - Borago officinalis - گل گاو زبان

Calamus - Acorus calamus - اگیر ترکی، اکیر ترکی

Camphre - Cinnamomum camphora - کافور

Carrot - Daucus carota - هویج

Chamomile, Camomile - Matricaria recutita - بابونه

Cinnamon - Cinnamomum zeylanicum - دارچین

Clary, Clary sage - Salvia sclarea - مریم گلی

Cubeb pepper, Cubeb - Piper cubeba - کبابه، کبابه چینی

Dog rose, Briar rose, Hip-rose - Rosa canina - نسترن وحشی، گل سگ

Feverfew - Chrysanthemum parthenium - بابونه گاوی

Fig - Ficus carica - انجیر، شال انجیر

Forest pepper - Toddalia asiatica Lam - دهن باز دهن بسته

Golden rod, Wound-weed - Solidago virgaurea - علف طلائی

Hop - Humulus lupulus - رازک

Horehound - Marrubium vulgare L - فراسیون

Hyssop - Hyssopus angustifolius - زوفا

Juniper - Juniperus communis L - پیرو، اربس

Lemongrass - Cymbopogon olivieri - پوتار، ناگرد، کاه مکی

Marigold, Calendula - Calendula officinalis - همیشه بهار

Mugwort, Mugwood - Artemisia vulgaris - برنجاسف، درمنه معمولی

Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش

Penny royal, Flea mint - Mentha pulegium - پونه معطر، خال واش، کوت کوتی

Perovskia - Perovskia abrotanoides - برازمبل

Sage, Garden sage - Salvia officinalis - مریم گلی باغی، مریم گلی دارویی

Small-leaved linden, Tillet tree - Tilia cordata - زیرفون، نمدار برگ‌ریز

St John's wort - Hypericum perforatum - گل راعی، هوفاریقون ، گل شهناز

Sumac - Rhus coriaria - سماق

Tea - Camellia sinensis - چای

Wormwood - Artemisia sieberi - درمنه

Yarrow - Achillea millefolium - بومادران

Refrences & Litretures:


17. Journal:'Pharm Biol' Year:'2013' Volume:'51' Page:'888' DOI:'10.3109/13880209.2013.768676' Title:'Volatile composition and antimicrobial activity of the essential oil of Artemisia absinthium growing in Western Ghats region of North West Karnataka, India'
18. Journal:'Journal of Chemistry' Year:'2015' Volume:'' Page:'804658' DOI:'10.1155/2015/804658' Title:'Chemical Composition and Antioxidant and Antimicrobial Activities of Wormwood (Artemisia absinthium L.) Essential Oils and Phenolics'
27. Journal:'ournal of Essential Oil Bearing Plants' Year:'2012' Volume:'15' Page:'32' DOI:'' Title:'Essential oil Composition and in vitro Antibacterial Activity of Rhizome Essential Oil and ?-Asarone from Acorus calamus L. Collected from Lower Himalayan Region of Utarakhand'
28. Journal:'Journal of Essential Oil Research' Year:'2008' Volume:'20' Page:'390' DOI:'' Title:'Comparison of Volatile Constituents of Acorus calamus and Asarum europaeum Obtained by Different Techniques'
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'
96. Journal:'Industrial Crops and Products' Year:'2011' Volume:'34' Page:'1482' DOI:'10.1016/j.indcrop.2011.05.005' Title:'Sesquiterpenic composition of the in?orescences of Brazilian chamomile (Matricaria recutita L.): Impact of the agricultural practices'
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'
158. Journal:'JOURNAL OF BIOSCIENCE AND BIOENGINEERING' Year:'2008' Volume:'105' Page:'176' DOI:'10.1263/jbb.105.176' Title:'Mass Propagation and Essential Oil Analysis of Artemisia vulgaris'
159. Journal:'CHEMIJA' Year:'2006' Volume:'17' Page:'12' DOI:'' Title:'Chemical composition of essential oils of Artemisia vulgaris L. (mugwort) from North Lithuania'
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'
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'
227. Journal:'World J Microbiol Biotechnol' Year:'2009' Volume:'25' Page:'2227' DOI:'10.1007/s11274-009-0130-3' Title:'Biological activities of the essential oils and methanol extract of tow cultivated mint species (Mentha longifolia and Mentha pulegium) used in the Tunisian folkloric medicine'
326. Journal:'Z. Naturforsch. C' Year:'2002' Volume:'57' Page:'990' DOI:'' Title:'Chemical Composition of Volatile Oil from Cinnamomum zeylanicum Buds'
328. Journal:'Journal of Agricultural Science and Technology A' Year:'2012' Volume:'2' Page:'392' DOI:'' Title:'Comparison of Essential Oils in Aerial Parts of Artemisia Sieberi from Kashan Province of Iran'
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'
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'
444. Journal:'FLAVOUR AND FRAGRANCE JOURNAL' Year:'1993' Volume:'8' Page:'209' DOI:'10.1002/ffj.2730080408' Title:'The Essential Oil of Rhus coriaria L. Fruits'
522. Journal:'Maced. J. Chem. Chem. Eng' Year:'2015' Volume:'34' Page:'333' DOI:'' Title:'Essential oil composition of indigenous populations of Hypericum perforatum L. from southern Albania'
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'
577. Journal:'J. Essent. Oil Res' Year:'2007' Volume:'19' Page:'14' DOI:'10.1080/10412905.2007.9699217' Title:'Essential Oil Constituents of Piper cubeba L. fils. from Indonesia'
640. Journal:'Plant Biosystems' Year:'2014' Volume:'148' Page:'444' DOI:'10.1080/11263504.2013.778349' Title:'Variation in anthocyanin and essential oil composition and their antioxidant potentialities during ?ower development of Borage (Borago of?cinalis L.)'
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'
680. Journal:'BIOLOGIJA' Year:'2005' Volume:'4' Page:'53' DOI:'' Title:'Chemical composition of essential oil and antimicrobial activity of Origanum vulgare'
690. Journal:'International Journal of Food Microbiology' Year:'2008' Volume:'125' Page:'242' DOI:'10.1016/j.ijfoodmicro.2008.04.005' Title:'Tunisian Salvia of?cinalis L. and Schinus molle L. essential oils: Their chemical compositions and their preservative effects against Salmonella inoculated in minced beef meat'
714. Journal:'African Journal of Biotechnology' Year:'2010' Volume:'9' Page:'2709' DOI:'' Title:'Phenols, essential oils and carotenoids of Rosa canina from Tunisia and their antioxidant activities'
731. Journal:'Brazilian Journal of Pharmaceutical Sciences' Year:'2008' Volume:'44' Page:'391' DOI:'' Title:'Analysis of the essential oils from Calendula officinalis growing in Brazil using three different extraction procedures'
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'
767. Journal:'Journal of Essential Oil Bearing Plants' Year:'2009' Volume:'12' Page:'205' DOI:'10.1080/0972060X.2009.10643712' Title:'Composition of the Essential oil of Perovskia abrotanoides Karel. and Mentha longifolia L. from Iran'
777. Journal:'Molecules' Year:'2009' Volume:'14' Page:'1438' DOI:'10.3390/molecules14041438' Title:'Chemical Composition and Biological Activities of Essential Oil from Salvia sclarea Plants Regenerated in vitro'
814. Journal:'Natural Products: An Indian Journal' Year:'2013' Volume:'9' Page:'16' DOI:'' Title:'Comparison investigation of essential oils in tea (Camellia sinensis L.var. sinensis) clones'
843. Journal:'Journal of Essential Oil Research' Year:'2010' Volume:'22' Page:'354' DOI:'10.1080/10412905.2010.9700344' Title:'Essential Oil Composition of Ephedra nebrodensis Tineo ex Guss. subsp. nebrodensis from Central Italy'
863. Journal:'Journal of Essential Oil Bearing Plants' Year:'2007' Volume:'10' Page:'310' DOI:'10.1080/0972060X.2007.10643560' Title:'Chemical Composition of Commercial Juniperus communis L. Leaf Oil'
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'
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)'
873. Journal:'Journal of Essential Oil Bearing Plants' Year:'2017' Volume:'20' Page:'1137' DOI:'10.1080/0972060X.2017.1359681' Title:'Essential Oil Composition of Tilia cordata Flowers'
874. Journal:'CHEMIJA' Year:'2007' Volume:'18' Page:'44' DOI:'' Title:'Influence of urban environment on chemical composition of essential oil of Tilia cordata'
875. Journal:'J. Essent. Oil Res' Year:'2007' Volume:'19' Page:'183' DOI:'10.1080/10412905.2007.9699255' Title:'olatile Constituents and Antimicrobial Activity of Tilia tomentosa Moench and Tilia cordata Miller Oils'
897. Journal:'Journal of Medicinal Plants and By-products' Year:'2016' Volume:'2' Page:'159' DOI:'' Title:'Essential Oils of Salvia hydrangea DC. ex Benth. from Kiasar-Hezarjarib regions, Iran-Impact of eEnvironmental Factors as Quality Determinants'
907. Journal:'Chem. Biodiversity' Year:'2017' Volume:'14' Page:'e1700096' DOI:'10.1002/cbdv.201700096' Title:'Cytotoxic Essential Oils from Eryngium campestre and Eryngium amethystinum (Apiaceae) Growing in Central Italy'
917. Journal:'International Letters of Chemistry, Physics and Astronomy' Year:'2013' Volume:'13' Page:'210' DOI:'10.18052/www.scipress.com/ILCPA.13.210' Title:'Chemical composition of Marrubium vulgare L. essential oil from Algeria'
972. Journal:'Journal of Medicinal Plants Research' Year:'2011' Volume:'5' Page:'6770' DOI:'10.5897/JMPR11.1098' Title:'Antibacterial and antimutagenic activity of extracts aboveground parts of three Solidago species: Solidago virgaurea L., Solidago canadensis L. and Solidago gigantea Ait'