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ScientificNameLabel
Vitispirane
PHCD compound ID : 1583
Chemical Names :
Vitispirane , vitispiran (isomer)
Molecular Formula : C13H20O1
Molecular Weight : 192.151415
More Details :
Names & Synonyms: 2,6,6-trimethyl-10-methylene-1-oxaspiro[4.5]dec-8-ene , 2,6,6-trimethyl-10-methylidene-1-oxaspiro[4.5]dec-8-ene
Smiles: C[C@@H]1CC[C@@]2(O1)C(=C)C=CCC2(C)C
InChi : InChI=1S/C13H20O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h5-6,11H,1,7-9H2,2-4H3/t11-,13-/m1/s1
InChi Key : InChIKey=DUPDJVDPPBFBPL-DGCLKSJQSA-N
PubChem ID : 6450832
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.018419
Hydrogen bond donor count : 0 Electric dipole moment : 1.794
XLogP : 2.725 VDW volume : 212.208651
Molecular weight : 192.151415 HOMO-LUMO gap : 9.461000
Herb list :
Refrences & Litretures:
  
174.      Journal:'Agric. Bioi. Chern'      Year:'1983'      Volume:'47'      Page:'2495'      DOI:'10.1080/00021369.1983.10865983'      Title:'Volatile Components of Quince Fruit (Cydonia oblonga Mill.)'
251.      Journal:'Journal of Essential Oil Research'      Year:'2004'      Volume:'16'      Page:'318'      DOI:'10.1080/10412905.2004.9698731'      Title:'Volatile Components of Tamarind (Tamarindus indica L.) Grown in Cuba'
555.      Journal:'Int. J. Adv. Biol. Biom. Res'      Year:'2015'      Volume:'3'      Page:'270'      DOI:''      Title:'The Chemical Composition and Antimicrobial Activity of Essential Oils of Vaccinium Arctostaphylos L'
556.      Journal:'Int. J. Agri. Biol'      Year:'2006'      Volume:'8'      Page:'8530'      DOI:''      Title:'Essential Oils of Qare-Qat (Vaccinium arctostaphylos) Shoots and Chemical Composition of Berries'
558.      Journal:'Pharmaceutical Biology'      Year:'2002'      Volume:'40'      Page:'448'      DOI:''      Title:'Steam Volatiles of Vaccinium arctostaphylos'
697.      Journal:'Rec. Nat. Prod'      Year:'2009'      Volume:'3'      Page:'90'      DOI:''      Title:'Chemical Composition of the Essential Oil of Pistacia lentiscus L. from Eastern Morocco'
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'
715.      Journal:'Z Naturforsch C'      Year:'2005'      Volume:'60'      Page:'369'      DOI:''      Title:'Chemical Composition of Hips Essential Oils of Some Rosa L. Species'
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