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ScientificNameLabel
Alloaromadendrene
PHCD compound ID : 604
Chemical Names :
Alloaromadendrene , Allo–Aromadendrene , Aromadendrene , Aromadendrene(allo)
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: (1aS,4aR,7aS,7bR)-1,1,7-trimethyl-4-methylene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene , (1aS,4aR,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene , (1aS,4aR,7aS,7bR)-1,1,7-trimethyl-4-methylene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cycloprop[e]azulene
Smiles: C[C@@H]1CC[C@@H]2[C@H]1[C@@H]1[C@@H](C1(C)C)CCC2=C
InChi : InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h10-14H,1,5-8H2,2-4H3/t10-,11+,12+,13+,14+/m1/s1
InChi Key : InChIKey=ITYNGVSTWVVPIC-QMVSFRDZSA-N
PubChem ID : 91746537
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.500415
Hydrogen bond donor count : 0 Electric dipole moment : 1.145
XLogP : 6.544 VDW volume : 228.290393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.922000
Herb list :
 
Balanga, Bragon's head - Lallemantia iberica - بالنگوی شهری
Basil, Sweet basil - Ocimum basilicum - ریحان، تخم شربتی
Betony - Stachys lavandulifolia Vahl - چای کوهی، سنبله ای زیبا
Bitter orange, Seville orange - Citrus aurantium - نارنج
Blue gum - Eucalyptus globulus - اکالیپتوس
Caraway - Carum carvi - زیره سیاه اروپائی
Catnip, Catmint - Nepeta cataria - نعناع گربه‌ای، پونه‌سای گربه‌ای
Erio yarrow - Achillea eriophora - بومادران
Fig - Ficus carica - انجیر، شال انجیر
Flixweed - Descurainia sophia - خاکشیر
Golden rod, Wound-weed - Solidago virgaurea - علف طلائی
Hemp - Cannabis sativa - شاهدانه
Madder - Rubia tinctorum - روناس
Mount atlas pistache - Pistacia atlantica - بنه، پسته کوهی
Oxtongue flower - Echium amoenum - گل گاو زبان
Perovskia - Perovskia abrotanoides - برازمبل
Thyme, Garden thyme - Thymus vulgaris - آويشن باغی
Turpentine tree - Pistacia terebinthus - پسته کوهی
Valerian - Valeriana officinalis - سنبل الطیب، والرین، سنبل الطیب اروپایی
Willd chamomile - Tripleurospermum disciforme - بابونه کاذب، بابونه دشتی
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'
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167.      Journal:'Industrial Crops and Products'      Year:'2010'      Volume:'31'      Page:'203'      DOI:'10.1016/j.indcrop.2009.10.003'      Title:'Antioxidant activities and chemical composition of essential oil of Pistacia atlantica from Algeria'
285.      Journal:'Journal of Herbal Drugs'      Year:'2013'      Volume:'4'      Page:'137'      DOI:''      Title:'Phytochemical of essential oil of Stachys lavandulifolia Vahl. collected from a natural habitat in western Isfahan, Iran'
296.      Journal:'Molecules'      Year:'2010'      Volume:'15'      Page:'233'      DOI:'10.3390/molecules15010233'      Title:'Determination of the Volatile Composition in Essential Oil of Descurainia sophia (L.) Webb ex Prantl (Flixweed) by Gas Chromatography/Mass Spectrometry (GC/MS)'
297.      Journal:'J Food Sci Technol'      Year:'2015'      Volume:'52'      Page:'4450'      DOI:'10.1007/s13197-014-1353-3'      Title:'Optimization of supercritical fluid extraction of essential oils and fatty acids from flixweed (Descurainia Sophia L.) seed using response surface methodology and central composite design'
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452.      Journal:'J. Agric. Food Chem'      Year:'2004'      Volume:'52'      Page:'3915'      DOI:'10.1021/jf0353990'      Title:'Essential Oil of Valeriana officinalis L. Cultivars and Their Antimicrobial Activity As Influenced by Harvesting Time under Commercial Organic Cultivation'
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'
529.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2004'      Volume:'7'      Page:'120'      DOI:'10.1080/0972-060X.2004.10643376'      Title:'Essential oils composition of Nepeta cataria L. and Nepeta crassifolia Boiss. and Buhse from Iran'
641.      Journal:'DARU'      Year:'2003'      Volume:'11'      Page:'32'      DOI:''      Title:'VOLATILE CONSTITUENTS OF A MEDICINAL PLANT OF IRAN, ECHIUM AMOENUM FISCH. AND C.A. MEY'
765.      Journal:'Jundishapur J Nat Pharm Prod'      Year:'2014'      Volume:'9'      Page:'1'      DOI:'10.17795/jjnpp-16432'      Title:'Influence of Environment on Glandular Trichomes and Composition of Essential Oil of Perovskia abrotanoides Karel'
832.      Journal:'Nutrition and Food Sciences Research'      Year:'2016'      Volume:'3'      Page:'43'      DOI:'10.18869/acadpub.nfsr.3.1.43'      Title:'Chemical Composition and Antimicrobial Activity of Leaf, Ripe and Unripe Peel of Bitter Orange (Citrus aurantium) Essential Oils'
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