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ScientificNameLabel
Petasitene
PHCD compound ID : 3032
Chemical Names :
Petasitene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms:
Smiles: CC(C1=CC[C@@]2([C@@]1(C)[C@@H]1CC[C@H]2C1)C)C
InChi : InChI=1S/C15H24/c1-10(2)13-7-8-14(3)11-5-6-12(9-11)15(13,14)4/h7,10-12H,5-6,8-9H2,1-4H3/t11-,12+,14-,15-/m0/s1
InChi Key : InChIKey=ZGKPBXWQOYDEMA-NEBZKDRISA-N
PubChem ID : 102587995
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.072188
Hydrogen bond donor count : 0 Electric dipole moment : 0.319
XLogP : 6.294 VDW volume : 228.290393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.478000
Herb list :
Refrences & Litretures:
  
385.      Journal:'Eur J Clin Microbiol Infect Dis'      Year:'2012'      Volume:'31'      Page:'1015'      DOI:'10.1007/s10096-011-1400-1'      Title:'Antistaphylococcal activity of Inula helenium L. root essential oil: eudesmane sesquiterpene lactones induce cell membrane damage'
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