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ScientificNameLabel
mintoxide
PHCD compound ID : 4809
Chemical Names :
mintoxide
Molecular Formula : C15H24O1
Molecular Weight : 220.182715
More Details :
Names & Synonyms:
Smiles: CC([C@@H]1CC[C@@]2([C@H]1[C@@H]1O[C@H]2CCC1=C)C)C
InChi : InChI=1S/C15H24O/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(16-12)13(11)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12-,13+,14+,15-/m0/s1
InChi Key : InChIKey=BITBXAWCPCNKKN-AHDPXTMNSA-N
PubChem ID : 91750040
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.579916
Hydrogen bond donor count : 0 Electric dipole moment : 2.114
XLogP : 3.913 VDW volume : 237.08062
Molecular weight : 220.182715 HOMO-LUMO gap : 10.641000
Herb list :
Refrences & Litretures:
  
777.      Journal:'Molecules'      Year:'2009'      Volume:'14'      Page:'1438'      DOI:'10.3390/molecules14041438'      Title:'Chemical Composition and Biological Activities of Essential Oil from Salvia sclarea Plants Regenerated in vitro'
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