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ScientificNameLabel
Beta-Panasinsense
PHCD compound ID : 5220
Chemical Names :
Beta-Panasinsense
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms:
Smiles: C=C1CCC[C@@]2([C@@]31CC([C@H]3CC2)(C)C)C
InChi : InChI=1S/C15H24/c1-11-6-5-8-14(4)9-7-12-13(2,3)10-15(11,12)14/h12H,1,5-10H2,2-4H3/t12-,14+,15-/m1/s1
InChi Key : InChIKey=LTMKWDWWHXRNMO-VHDGCEQUSA-N
PubChem ID :
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.469999
Hydrogen bond donor count : 0 Electric dipole moment : 0.913
XLogP : 6.546 VDW volume : 228.290393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.792000
Herb list :
Refrences & Litretures:
  
825.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2011'      Volume:'14'      Page:'498'      DOI:'10.1080/0972060X.2011.10643608'      Title:'Chemical Composition and Antimicrobial Activity of Chenopodium botrys L. Essential Oil'
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