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ScientificNameLabel
Alpha-Santalol
PHCD compound ID : 390
Chemical Names :
Alpha-Santalol
Molecular Formula : C15H24O1
Molecular Weight : 220.182715
More Details :
Names & Synonyms: (Z)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptan-3-yl)-2-methyl-pent-2-en-1-ol , (Z)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptan-3-yl)-2-methyl-2-penten-1-ol , (Z)-5-(2,3-dimethyl-4,5,6,7-tetrahydro-1H-tricyclo[2.2.1.0^{2,6}]heptan-3-yl)-2-methylpent-2-en-1-ol
Smiles: OC/C(=C\CC[C@@]1(C)[C@@H]2C[C@@H]3[C@@]1(C)[C@@H]3C2)/C
InChi : InChI=1S/C15H24O/c1-10(9-16)5-4-6-14(2)11-7-12-13(8-11)15(12,14)3/h5,11-13,16H,4,6-9H2,1-3H3/b10-5-/t11-,12+,13-,14-,15+/m0/s1
InChi Key : InChIKey=PDEQKAVEYSOLJX-SCDJRVRESA-N
PubChem ID : 5281531
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.457573
Hydrogen bond donor count : 1 Electric dipole moment : 2.010
XLogP : 4.825 VDW volume : 237.08062
Molecular weight : 220.182715 HOMO-LUMO gap : 10.478000
Herb list :
Refrences & Litretures:
  
22.      Journal:'Z Lebensm Unters Forsch A'      Year:'1999'      Volume:'208'      Page:'212'      DOI:''      Title:'Effect of extraction techniques on the chemical composition and antioxidant activity of Eucalyptus camaldulensis var. brevirostris leaf oils'
96.      Journal:'Industrial Crops and Products'      Year:'2011'      Volume:'34'      Page:'1482'      DOI:'10.1016/j.indcrop.2011.05.005'      Title:'Sesquiterpenic composition of the in?orescences of Brazilian chamomile (Matricaria recutita L.): Impact of the agricultural practices'
296.      Journal:'Molecules'      Year:'2010'      Volume:'15'      Page:'233'      DOI:'10.3390/molecules15010233'      Title:'Determination of the Volatile Composition in Essential Oil of Descurainia sophia (L.) Webb ex Prantl (Flixweed) by Gas Chromatography/Mass Spectrometry (GC/MS)'
765.      Journal:'Jundishapur J Nat Pharm Prod'      Year:'2014'      Volume:'9'      Page:'1'      DOI:'10.17795/jjnpp-16432'      Title:'Influence of Environment on Glandular Trichomes and Composition of Essential Oil of Perovskia abrotanoides Karel'
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