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ScientificNameLabel
O-Methylthymol
PHCD compound ID : 819
Chemical Names :
Thymol methyl ether , Thymol,Methyl ether , Methyl thymylether , Methyl ether thymol , Thymol methylether , Thymyl methyl ether , Methyl thymyl ether , O-Methylthymol , Thymol methyl ether isomer , Thymol methyl ether ti , Thymolmethyl ether
Molecular Formula : C11H16O1
Molecular Weight : 164.120115
More Details :
Names & Synonyms: 1-isopropyl-2-methoxy-4-methyl-benzene , 2-methoxy-4-methyl-1-propan-2-ylbenzene , 2-methoxy-4-methyl-1-propan-2-yl-benzene
Smiles: COc1cc(C)ccc1C(C)C
InChi : InChI=1S/C11H16O/c1-8(2)10-6-5-9(3)7-11(10)12-4/h5-8H,1-4H3
InChi Key : InChIKey=LSQXNMXDFRRDSJ-UHFFFAOYSA-N
PubChem ID : 14104
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.640905
Hydrogen bond donor count : 0 Electric dipole moment : 1.472
XLogP : 2.808 VDW volume : 176.436681
Molecular weight : 164.120115 HOMO-LUMO gap : 9.065000
Herb list :
 
- Satureja khuzestanica - مرزه خوزستانی
- Thymus daenensis - آویشن دنائی
Black cumin, Nutmeg flower, Fennel-flower, Roman coriander - Nigella sativa - سیاه دانه، شونیز
Crab's eye - Abrus precatorius - چشم خروس، آبروس، چشم خرچنگی
Gum amoniacum, Ammoniac - Dorema ammoniacum - وشا، وشق، کماکندل، کندر
Kotschyam thyme - Thymus kotschyanus - آويشن
Lemongrass - Cymbopogon olivieri - پوتار، ناگرد، کاه مکی
Mountain tobacco - Arnica montana - تنباکوی کوهی
Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش
Red pepper - Capsicum annuum - فلفل قرمز
Saatar, Zataria - Zataria multiflora - آویشن شیرازی، ازکند
Small-leaved linden, Tillet tree - Tilia cordata - زیرفون، نمدار برگ‌ریز
Thyme, Garden thyme - Thymus vulgaris - آويشن باغی
Valerian - Valeriana officinalis - سنبل الطیب، والرین، سنبل الطیب اروپایی
Refrences & Litretures:
  
59.      Journal:'Phytother. Res'      Year:'2004'      Volume:'18'      Page:'990'      DOI:'10.1002/ptr.1594'      Title:'Antifungal Effect of Various Essential Oils against Candida albicans. Potentiation of Antifungal Action of Amphotericin B by Essential Oil from Thymus vulgaris'
60.      Journal:'Food Control'      Year:'2008'      Volume:'19'      Page:'681'      DOI:'10.1016/j.foodcont.2007.07.007'      Title:'Antimicrobial activity and chemical composition of Thymus vulgaris, Thymus zygis and Thymus hyemalis essential oils'
61.      Journal:'Talanta'      Year:'2008'      Volume:'76'      Page:'878'      DOI:'10.1016/j.talanta.2008.04.050'      Title:'Application of PLE for the determination of essential oil components from Thymus vulgaris L'
64.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2014'      Volume:'17'      Page:'538'      DOI:'10.1080/0972060X.2014.935044'      Title:'Chemical Composition of the Essential Oil of Thymus vulgaris L. Grown in Iran'
66.      Journal:'Food Chemistry'      Year:'2008'      Volume:'109'      Page:'925'      DOI:'10.1016/j.foodchem.2007.12.084'      Title:'Comparison of microwave-assisted hydrodistillation with the traditional hydrodistillation method in the extraction of essential oils from Thymus vulgaris L'
67.      Journal:'Innovative Food Science and Emerging Technologies'      Year:'2012'      Volume:'14'      Page:'85'      DOI:'10.1016/j.ifset.2012.01.002'      Title:'Comparison of ohmic-assisted hydrodistillation with traditional hydrodistillation for the extraction of essential oils from Thymus vulgaris L'
68.      Journal:'Environmental and Experimental Botany'      Year:'2009'      Volume:'65'      Page:'99'      DOI:'10.1016/j.envexpbot.2008.09.001'      Title:'Elevated atmospheric CO2 decreases oxidative stress and increases essential oil yield in leaves of Thymus vulgaris grown in a mini-FACE system'
69.      Journal:'Journal of Research & Development'      Year:'2011'      Volume:'11'      Page:'83'      DOI:''      Title:'Essential Oil Composition of Thymus Vulgaris L. and their Uses'
70.      Journal:'Journal of Pharmaceutical and Biomedical Analysis'      Year:'2002'      Volume:'29'      Page:'691'      DOI:''      Title:'GC/MS evaluation of thyme (Thymus vulgaris L.) oil composition and variations during the vegetative cycle'
73.      Journal:'J. Sep. Sci'      Year:'2009'      Volume:'32'      Page:'3034'      DOI:'10.1002/jssc.200900214'      Title:'Static and dynamic superheated water extraction of essential oil components fromThymus vulgaris L'
77.      Journal:'Annals of Biological Research'      Year:'2012'      Volume:'3'      Page:'1443'      DOI:''      Title:'Comparative Study of the Essential Oil Chemical Composition of Thymus Kotschyanus Boiss. & Hohen var. kotschyanus from Iran'
80.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'117'      DOI:'10.1080/0972060X.2013.764159'      Title:'Essential Oil Compositions of Thymus kotschyanus Boiss. Obtained by Hydrodistillation and Microwave Oven Distillation'
82.      Journal:'Journal of Medicinal Plants'      Year:'2011'      Volume:'10'      Page:'12'      DOI:''      Title:'Application of Satureja hortensis L. and Zataria multiflora Boiss. Essential Oils as Two Natural Antioxidants in Soybean Oil During Microwave Heating'
84.      Journal:'European Journal of Experimental Biology'      Year:'2014'      Volume:'4'      Page:'253'      DOI:''      Title:'Chemical composition and insecticidal activity of essential oil of Zataria multiflora Boiss. (Lamiaceae) against Ephestia kuehniella (Lepidoptera: Pyralidae)'
85.      Journal:'Food and Chemical Toxicology'      Year:'2010'      Volume:'48'      Page:'1562'      DOI:'10.1016/j.fct.2010.03.025'      Title:'Chemical composition of essential oils in Zataria multi?ora Boiss. From different parts of Iran and their radical scavenging and antimicrobial activity'
87.      Journal:'Journal of Food Safety'      Year:'2012'      Volume:''      Page:'1'      DOI:'10.1111/j.1745-4565.2012.00384.x'      Title:'CHEMICAL COMPOSITION, RADICAL SCAVENGING, ANTIBACTERIAL AND ANTIFUNGAL ACTIVITIES OF ZATARIA MULTIFLORA BIOSS ESSENTIAL OIL AND AQUEOUS EXTRACT'
89.      Journal:'Food Control'      Year:'2007'      Volume:'18'      Page:'1043'      DOI:'10.1016/j.foodcont.2006.06.010'      Title:'Effects of Zataria multiflora Boiss. essential oil and nisin on Bacillus cereus ATCC 11778'
90.      Journal:'Food Control'      Year:'2007'      Volume:'18'      Page:'800'      DOI:'10.1016/j.foodcont.2006.04.002'      Title:'In vitro evaluation of antibacterial and antioxidant activities of the essential oil and methanol extract of endemic Zataria multi?ora Boiss'
91.      Journal:'Eur. J. Lipid Sci. Technol'      Year:'2008'      Volume:'110'      Page:'448'      DOI:'10.1002/ejlt.200700239'      Title:'Microwave-assisted hydrodistillation of essential oil from Zataria multiflora Boiss'
212.      Journal:'Iranian Journal of Pharmaceutical Research'      Year:'2006'      Volume:'1'      Page:'65'      DOI:''      Title:'Antimicrobial Activity and Composition of the Essential Oil of Cymbopogon Olivieri (Boiss.) Bor from Iran'
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'
449.      Journal:'Molecules'      Year:'2010'      Volume:'15'      Page:'6411'      DOI:'10.3390/molecules15096411'      Title:'Chemical Analysis and Biological Activity of the Essential Oils of Two Valerianaceous Species from China: Nardostachys chinensis and Valeriana officinalis'
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'
453.      Journal:'FLAVOUR AND FRAGRANCE JOURNAL'      Year:'1997'      Volume:'12'      Page:'359'      DOI:''      Title:'Composition of the Essential Oils from Underground Parts of Valeriana o?cinalis L. s.l. and Several Closely Related Taxa'
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'
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'
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'
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'
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'
679.      Journal:'Natural Product Research'      Year:'2012'      Volume:'26'      Page:'140'      DOI:'10.1080/14786419.2010.535150'      Title:'Chemical markers in Origanum vulgare L. from Kumaon Himalayas: a chemosystematic study'
687.      Journal:'Iranian Journal of Pharmaceutical Research'      Year:'2012'      Volume:'11'      Page:'1219'      DOI:''      Title:'Hepatoprotective and Hypolipidemic Effects of Satureja Khuzestanica Essential Oil in Alloxan-induced Type 1 Diabetic Rats'
689.      Journal:'International Journal of Food Science and Technology'      Year:'2012'      Volume:'47'      Page:'1579'      DOI:'10.1111/j.1365-2621.2012.03006.x'      Title:'Chemical composition, antioxidative capacity and interactive antimicrobial potency of Satureja khuzestanica Jamzad essential oil and antimicrobial agents against selected food-related microorganisms'
742.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2014'      Volume:'17'      Page:'1287'      DOI:'10.1080/0972060X.2014.977572'      Title:'Comparing Stem and Seed Essential Oil in Dorema ammoniacum D. Don. From Iran'
744.      Journal:'Research Journal of Pharmaceutical, Biological and Chemical Sciences'      Year:'2013'      Volume:'4'      Page:'640'      DOI:''      Title:'Chemical Composition of the Essential Oils from Flowers, Stems and Roots of Dorema ammoniacum D.Don from Iran'
778.      Journal:'Industrial Crops and Products'      Year:'2013'      Volume:'49'      Page:'97'      DOI:'10.1016/j.indcrop.2013.04.029'      Title:'Influence of storage conditions on the essential oil composition ofThymus daenensis Celak'
779.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'59'      DOI:'10.1080/0972060X.2013.764190'      Title:'Essential Oil Composition, Total Phenolic Content, Antioxidant Activity and Antifungal Properties of Iranian Thymus daenensis subsp. Daenensis Celak. as in Influenced by Ontogenetical Variation'
782.      Journal:'Asian Pac J Trop Dis'      Year:'2016'      Volume:'6'      Page:'372'      DOI:'10.1016/S2222-1808(15)61050-7'      Title:'GC-MS analysis and cytotoxic activity of essential oils from the leaves of Abrus precatorius L. Gaertn'
874.      Journal:'CHEMIJA'      Year:'2007'      Volume:'18'      Page:'44'      DOI:''      Title:'Influence of urban environment on chemical composition of essential oil of Tilia cordata'
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