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ScientificNameLabel
Estragol
PHCD compound ID : 426
Chemical Names :
Estragole , Methyl chavicol , methylchavicol , Esdragole , Estragol , P-Allylanisole , methyl-chavicol , Menthyl chavicol
Molecular Formula : C10H12O1
Molecular Weight : 148.088815
More Details :
Names & Synonyms: 1-allyl-4-methoxy-benzene , 1-methoxy-4-prop-2-enylbenzene , 1-methoxy-4-prop-2-enyl-benzene
Smiles: COc1ccc(cc1)CC=C
InChi : InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
InChi Key : InChIKey=ZFMSMUAANRJZFM-UHFFFAOYSA-N
PubChem ID : 8815
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.801390
Hydrogen bond donor count : 0 Electric dipole moment : 1.289
XLogP : 2.515 VDW volume : 156.504238
Molecular weight : 148.088815 HOMO-LUMO gap : 8.991000
Herb list :
 
- Anacyclus pyrethrum - عاقرقرحا
Anise - Pimpinella anisum - انيسون
Balm mint - Melissa officinalis - فرنجمشک، وارنگ بو، بارنگ بو
Barley - Hordeum vulgare - جو
Basil, Sweet basil - Ocimum basilicum - ریحان، تخم شربتی
Bay - Laurus nobilis - برگ بو
Bishop's weed, Bullwort - Trachyspermum copticum - زنیان، بادیان رومی، نانخواه
Black cumin, Nutmeg flower, Fennel-flower, Roman coriander - Nigella sativa - سیاه دانه، شونیز
Calamus - Acorus calamus - اگیر ترکی، اکیر ترکی
Clove - Eugenia caryophyllata - میخک هندی، میخک
Cow-parsnip - Heracleum persicum - گلپر
Erio yarrow - Achillea eriophora - بومادران
Fennel - Foeniculum vulgare - رازیانه
Garlic - Allium sativum - سیر
Kundur luban, Salai - Boswellia serrata - لیبان، کندر
Lovage - Levisticum officinale - انجدان
Marigold, Calendula - Calendula officinalis - همیشه بهار
Myrtle - Myrtus communis - مورد
Nettle, Stinging nettle - Urtica dioica - گزنه دو پایه، گزنه
Red pepper - Capsicum annuum - فلفل قرمز
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
Tarragon, Wild dragon - Artemisia dracunculus - ترخون
Tea - Camellia sinensis - چای
Thyme, Garden thyme - Thymus vulgaris - آويشن باغی
Wild cucumber, Squirting cucumber - Ecballium elaterium - خرخیار، خیارخر، خیار آب پران
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'
42.      Journal:'Annals of Microbiology'      Year:'2006'      Volume:'56'      Page:'353'      DOI:''      Title:'Chemical composition and antifungal effect of anise (Pimpinella anisum L.) fruit oil at ripening stage'
43.      Journal:'Food Chemistry'      Year:'2006'      Volume:'97'      Page:'719'      DOI:'10.1016/j.foodchem.2005.05.045'      Title:'Screening of the antioxidative and antimicrobial properties of the essential oils of Pimpinella anisetum and Pimpinella ?abellifolia from Turkey'
44.      Journal:'J. Agric. Food Chem'      Year:'2003'      Volume:'51'      Page:'1518'      DOI:'10.1021/jf0257493'      Title:'Supercritical Extraction of Essential Oil from Aniseed (Pimpinella anisum L) Using CO2: Solubility, Kinetics, and Composition Data'
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71.      Journal:'Food Chemistry'      Year:'2005'      Volume:'91'      Page:'131'      DOI:'10.1016/j.foodchem.2004.05.056'      Title:'Identi?cation of volatile components in basil (Ocimum basilicum L.) and thyme leaves (Thymus vulgaris L.) and their antioxidant properties'
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'
154.      Journal:'Flavour Fragr. J'      Year:'1997'      Volume:'12'      Page:'71'      DOI:''      Title:'Constituents of the Essential Oil of Achillea eriophora DC'
238.      Journal:'Jundishapur J Microbiol'      Year:'2013'      Volume:'6'      Page:'e7877'      DOI:'10.5812/jjm.7877'      Title:'The Evaluation of the Antibacterial and Antioxidant Activity of Tarragon (Artemisia dracunculus L.) Essential Oil and Its Chemical Composition'
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240.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2010'      Volume:'13'      Page:'331'      DOI:'10.1080/0972060X.2010.10643830'      Title:'Essential Oil Composition of Artemisia dracunculus L. (Tarragon) Growing in Kashmir -India'
242.      Journal:'J Sci Food Agric'      Year:'2006'      Volume:'86'      Page:'2543'      DOI:''      Title:'Loss of essential oil of tarragon (Artemisia dracunculus L.) due to drying'
266.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'817'      DOI:'10.1080/0972060X.2013.841364'      Title:'Effects of Essential Oils of Lavandula x hybrida Rev, Foeniculum vulgare Mill and Thymus capitatus L. on the Germination and Radical Length of Triticum aestivum L., Hordeum vulgare L., Lolium rigidum L. and Phalaris brachystachys L'
300.      Journal:'Natural Product Research'      Year:'2010'      Volume:'24'      Page:'1704'      DOI:'10.1080/14786410902884933'      Title:'Phytochemical analysis and allelopathic activity of essential oils of Ecballium elaterium A. Richard growing in Iran'
344.      Journal:'Food Control'      Year:'2014'      Volume:'35'      Page:'109'      DOI:'10.1016/j.foodcont.2013.06.056'      Title:'Chemical composition, antibacterial activity and mechanism of action of essential oil from seeds of fennel (Foeniculum vulgare Mill.)'
345.      Journal:'Arabian Journal of Chemistry'      Year:'2014'      Volume:'7'      Page:'480'      DOI:'10.1016/j.arabjc.2010.11.006'      Title:'Chemical composition and larvicidal activity of Algerian Foeniculum vulgare seed essential oil'
346.      Journal:'African Journal of Biotechnology'      Year:'2008'      Volume:'7'      Page:'4364'      DOI:''      Title:'Composition and antimicrobial properties of essential oil of Foeniculum vulgare'
347.      Journal:'Flavour Fragr. J'      Year:'2009'      Volume:'24'      Page:'170'      DOI:'10.1002/ffj.1929'      Title:'Antioxidant and antimicrobial activities of essential oil and extracts of fennel (Foeniculum vulgare Mill.) seeds from Pakistan'
348.      Journal:'Pharmacological Research'      Year:'2007'      Volume:'56'      Page:'254'      DOI:'10.1016/j.phrs.2007.07.002'      Title:'Protective effect of Foeniculum vulgare essential oil and anethole in an experimental model of thrombosis'
349.      Journal:'Psyche: A Journal of Entomology'      Year:'2014'      Volume:'2014'      Page:'1'      DOI:'10.1155/2014/424078'      Title:'Chemical Composition and Acaricidal Effects of Essential Oils of Foeniculum vulgare Mill. (Apiales: Apiaceae) and Lavandula angustifolia Miller (Lamiales: Lamiaceae) against Tetranychus urticae Koch (Acari: Tetranychidae)'
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'
351.      Journal:'Food Chemistry'      Year:'2005'      Volume:'92'      Page:'143'      DOI:'10.1016'      Title:'Extraction of fennel (Foeniculum vulgare Mill.) seeds with supercritical CO2: Comparison with hydrodistillation'
352.      Journal:'Food Control'      Year:'2006'      Volume:'17'      Page:'745'      DOI:'10.1016/j.foodcont.2005.03.010'      Title:'Chemical constituents, antifungal and antioxidative potential of Foeniculum vulgare volatile oil and its acetone extract'
362.      Journal:'Parasitol Res'      Year:'2011'      Volume:'108'      Page:'481'      DOI:'10.1007/s00436-010-2069-6'      Title:'Acaricidal effect and chemical composition of essential oils extracted from Cuminum cyminum, Pimenta dioica and Ocimum basilicum against the cattle tick Rhipicephalus (Boophilus) microplus (Acari: Ixodidae)'
364.      Journal:'Food Chemistry'      Year:'2008'      Volume:'110'      Page:'501'      DOI:'10.1016/j.foodchem.2008.02.018'      Title:'Comparative essential oil composition of flowers, leaves and stems of basil (Ocimum basilicum L.) used as herb'
393.      Journal:'J. Essent. Oil Res'      Year:'1993'      Volume:'5'      Page:'105'      DOI:'10.1080/10412905.1993.9698181'      Title:'Essential Oil Constituents of Trachyspermum copticum (L.) Link Fruits'
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'
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467.      Journal:'Journal of Economic Entomology'      Year:'2013'      Volume:'106'      Page:'1349'      DOI:'10.1603/EC12191'      Title:'Evaluation of Acute Toxicity of Essential Oil of Garlic (Allium sativum) and Its Selected Major Constituent Compounds Against Overwintering Cacopsylla chinensis (Hemiptera: Psyllidae)'
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'
542.      Journal:'Folia Pomer. Univ. Technol. Stetin., Agric., Aliment., Pisc., Zootech'      Year:'2015'      Volume:'320'      Page:'95'      DOI:''      Title:'GC-MS ANALYSIS OF ESSENTIAL OILS ISOLATED FROM FRUITS OF CHOSEN HOT PEPPER (CAPSICUM ANNUUM L.) CULTIVARS'
592.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'318'      DOI:'10.1080/0972060X.2013.764187'      Title:'Changes in Content and Constituents of Essential Oil in Different Plant Parts of Lovage (Levisticum officinale Koch. Cv. Budakalaszi) Cultivated in Iran'
617.      Journal:'Bull Environ Contam Toxicol'      Year:'2012'      Volume:'88'      Page:'666'      DOI:'10.1007/s00128-012-0535-9'      Title:'Chemical Composition and In Vitro Cytotoxic, Genotoxic Effects of Essential Oil from Urtica dioica L'
649.      Journal:'Journal of Essential Oil Research'      Year:'2004'      Volume:'16'      Page:'296'      DOI:'10.1080/10412905.2004.9698725'      Title:'Analysis of the Oil of Heracleum persicum L. (Seeds and Stems)'
651.      Journal:'Bioscience Research'      Year:'2005'      Volume:'2'      Page:'107'      DOI:''      Title:'Cytotoxicity and chemical constituents of the volatile oil of golpar (heracleum persicum desf. Ex Fischer)'
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)'
698.      Journal:'Journal of Essential Oil Research'      Year:'2015'      Volume:'27'      Page:'465'      DOI:'10.1080/10412905.2015.1065773'      Title:'Chemical composition of essential oils of leaves and flowers from five cultivars of myrtle (Myrtus communis L.)'
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732.      Journal:'Chromatographia'      Year:'2011'      Volume:'73'      Page:'s163'      DOI:'10.1007/s10337-011-1910-0'      Title:'Chemical Composition and Chemometric Analysis of Variation in Essential Oils of Calendula officinalis L. during Vegetation Stages'
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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'
910.      Journal:'Mediterranean Journal of Chemistry'      Year:'2020'      Volume:'10'      Page:'13'      DOI:'10.13171/mjc101020211198kem'      Title:'Chemical composition and insecticidal activity of Anacyclus pyrethrum essential oil from the Bensliman area against Culex pipiens'
920.      Journal:'International Journal of Traditional and Natural Medicines'      Year:'2013'      Volume:'2'      Page:'86'      DOI:''      Title:'Composition and Bioactivity of the Essential Oil of Melissa officinalis L. Growing Wild in Tajikistan'
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