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ScientificNameLabel
Geranyl formate
PHCD compound ID : 820
Chemical Names :
Geranyl formate , Geraniolformate
Molecular Formula : C11H18O2
Molecular Weight : 182.13068
More Details :
Names & Synonyms: [(2E)-3,7-dimethylocta-2,6-dienyl] formate , formic acid [(2E)-3,7-dimethylocta-2,6-dienyl] ester , [(2E)-3,7-dimethylocta-2,6-dienyl] methanoate
Smiles: O=COC/C=C(/CCC=C(C)C)\C
InChi : InChI=1S/C11H18O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h5,7,9H,4,6,8H2,1-3H3/b11-7+
InChi Key : InChIKey=FQMZVFJYMPNUCT-YRNVUSSQSA-N
PubChem ID : 5282109
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.044994
Hydrogen bond donor count : 0 Electric dipole moment : 0.989
XLogP : 3.028 VDW volume : 208.483367
Molecular weight : 182.13068 HOMO-LUMO gap : 9.994000
Herb list :
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'
74.      Journal:'Food Chemistry'      Year:'1998'      Volume:'63'      Page:'373'      DOI:''      Title:'Study of the composition of the different parts of a Spanish Thymes vulgaris L. plant'
111.      Journal:'Pharmaceutical sciences'      Year:'2013'      Volume:'18'      Page:'187'      DOI:''      Title:'Chemical Composition and Antinociceptive Effect of the Essential Oil of Dracocephalum moldavica L'
153.      Journal:'Chemistry of Natural Compounds'      Year:'2008'      Volume:'44'      Page:'663'      DOI:''      Title:'COMPOSITION AND IN VITRO ANTIMICROBIAL ACTIVITY OF THE ESSENTIAL OIL OF Achillea eriophora'
530.      Journal:'J. Agric. Food Chem'      Year:'2003'      Volume:'51'      Page:'3840'      DOI:'10.1021/jf021187b'      Title:'Sensory and Instrumental Evaluation of Catnip (Nepeta cataria L.) Aroma'
605.      Journal:'J Sci Food Agric'      Year:'2013'      Volume:'93'      Page:'2494'      DOI:'10.1002/jsfa.6065'      Title:'Chemical constituents and anti-ulcerogenic potential of the scales of Cynara scolymus (artichoke) heads'
634.      Journal:'Chemistry of Natural Compounds'      Year:'2009'      Volume:'45'      Page:'110'      DOI:''      Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF Rosa damascena FROM TWO DIFFERENT LOCATIONS IN IRAN'
672.      Journal:'Molecules'      Year:'2012'      Volume:'17'      Page:'11173'      DOI:'10.3390/molecules170911173'      Title:'Chemical Composition of Hexane Extract of Citrus aurantifolia and Anti-Mycobacterium tuberculosis Activity of Some of Its Constituents'
775.      Journal:'J. BioSci. Biotech'      Year:'2013'      Volume:'2'      Page:'39'      DOI:''      Title:'Chemical composition and antifungal activity of essential oil of Salvia sclarea L. from Bulgaria against clinical isolates of Candida species'
776.      Journal:'International Journal of Agriculture and Crop Sciences'      Year:'2013'      Volume:'5'      Page:'828'      DOI:''      Title:'Comparison of Salvia sclarea L. Essential Oil Components in Wild and Field Population'
877.      Journal:'Journal of Applied Pharmaceutical Science'      Year:'2014'      Volume:'4'      Page:'1'      DOI:'10.7324/JAPS.2014.40301'      Title:'Chemical composition, antifungal and antioxidant activity of Pelargonium graveolens essential oil'
878.      Journal:'Iran J Microbiol'      Year:'2012'      Volume:'4'      Page:'171'      DOI:''      Title:'Antibacterial activity and composition of essential oils from Pelargonium graveolens L’Her and Vitex agnus-castus L'
879.      Journal:'Journal of Essential Oil Research'      Year:'2013'      Volume:'25'      Page:'372'      DOI:'10.1080/10412905.2013.782476'      Title:'Essential oil composition of Pelargonium graveolens L’Her ex Ait. cultivars harvested in different seasons'
880.      Journal:'Phytother. Res'      Year:'2013'      Volume:'27'      Page:'1206'      DOI:'10.1002/ptr.4853'      Title:'Chemical composition and biological activities of polar extracts and essential oil of rose-scented geranium, Pelargonium graveolens'
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