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Phytane
PHCD compound ID : 45
Chemical Names :
2,6,10,14-Tetramethyl hexadecane , Phytane , Hexadecane,2,6,10,14-tetramethyl- , 2,6,10,14-Tetramethylhexadecane
Molecular Formula : C20H42
Molecular Weight : 282.328651
More Details :
Names & Synonyms: 2,6,10,14-tetramethylhexadecane
Smiles: CC[C@H](CCC[C@H](CCC[C@@H](CCCC(C)C)C)C)C
InChi : InChI=1S/C20H42/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h17-20H,7-16H2,1-6H3/t18-,19-,20-/m1/s1
InChi Key : InChIKey=GGYKPYDKXLHNTI-VAMGGRTRSA-N
PubChem ID : 12523
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 0 Ionization potential : 10.603172
Hydrogen bond donor count : 0 Electric dipole moment : 0.113
XLogP : 11.476 VDW volume : 354.476151
Molecular weight : 282.328651 HOMO-LUMO gap : 14.486000
Herb list :
Refrences & Litretures:
  
2.      Journal:'Z. Naturforsch'      Year:'2005'      Volume:'60'      Page:'707'      DOI:''      Title:'Antimicrobial Activity and Main Chemical Composition of Two Smoke Condensates from Peganum harmala Seeds'
36.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2010'      Volume:'13'      Page:'316'      DOI:'10.1080/0972060X.2010.10643827'      Title:'Volatile Constituents of Leaves of Ficus carica Linn. Grown in Egypt'
546.      Journal:'Food Chemistry'      Year:'2007'      Volume:'102'      Page:'1096'      DOI:'10.1016/j.foodchem.2006.06.047'      Title:'Chemical and biological variability of hot pepper fruits (Capsicum annuum var. acuminatum L.) in relation to maturity stage'
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'
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