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Rimuene(Tetrahydro-)
PHCD compound ID : 1061
Chemical Names :
Rimuene(Tetrahydro-)
Molecular Formula : C20H36
Molecular Weight : 276.281701
More Details :
Names & Synonyms: (2R,4aR,4bR,8aR,10aR)-2-ethyl-2,4a,8,8-tetramethyl-3,4,4b,5,6,7,8a,9,10,10a-decahydro-1H-phenanthrene
Smiles: CC[C@]1(C)CC[C@@]2([C@@H](C1)CC[C@@H]1[C@H]2CCCC1(C)C)C
InChi : InChI=1S/C20H36/c1-6-19(4)12-13-20(5)15(14-19)9-10-16-17(20)8-7-11-18(16,2)3/h15-17H,6-14H2,1-5H3/t15-,16-,17-,19-,20-/m1/s1
InChi Key : InChIKey=CZEZFPXHDTYEBI-UNNPPQAFSA-N
PubChem ID : 9548871
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.830830
Hydrogen bond donor count : 0 Electric dipole moment : 0.033
XLogP : 10.445 VDW volume : 317.406775
Molecular weight : 276.281701 HOMO-LUMO gap : 13.555000
Herb list :
Refrences & Litretures:
  
109.      Journal:'AGRICULTURAL COMMUNICATIONS'      Year:'2014'      Volume:'2'      Page:'42'      DOI:''      Title:'Effect of Different Salinity Levels on Essential Oil Content and Composition of Dracocephalum moldavica'
110.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'346'      DOI:'10.1080/0972060X.2013.813237'      Title:'Comparison of Essential Oil Composition in Dracocephalum moldavica in Greenhouse and Field'
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