General Information of Natural Product (ID: NP0492)
  Natural Product Name
(-)-Alpha-Isocomene
  Synonyms
(-)-alpha-isocomene; (-)-Isocomene; (1R,3aS,5aS,8aR)-1,3a,4,5a-tetramethyl-1,2,3,3a,5a,6,7,8-octahydrocyclopenta[c]pentalene; Berkheyaradulene; alpha-Isocomene; CHEBI:68666; 65372-78-3; ZINC71785871; C20477; Q27137092; Cyclopenta(a)pentalene, 1,2,3,3a,5a,6,7,8-octahydro-1,3a,4,5a-tetramethyl-, (S-(1alpha,3aalpha,5abeta,8aR*))-
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  Formula C15H24
  Weight 204.35
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C15H24/c1-11-6-9-14(4)12(2)10-13(3)7-5-8-15(11,13)14/h10-11H,5-9H2,1-4H3/t11-,13+,14+,15-/m1/s1
  InChI Key SAOJPWFHRMUCFN-UQOMUDLDSA-N
  Isomeric SMILES C[C@@H]1CC[C@@]2([C@]13CCC[C@]3(C=C2C)C)C
  Canonical SMILES CC1CCC2(C13CCCC3(C=C2C)C)C
  External Links PubChem ID 57501472
CAS ID 65372-78-3

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Tanacetum larvatum
  Factor Name: Locality Variation [1]
              Species Info Factor Info
               Experiment Detail
Aerial parts of T. larvatum were collected in July and August during a five-year period, starting in 2001, in Montenegro on several locations: Planinica (Sample a), Visitor (Sample b) and Sinjajevina (Sample c).
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               Factor Function
Sixty-four components were identified, representing 83.1%, 96.6% and 89.4% of the total oils content in the Planinica [Sample a], Visitor [Sample b] and Sinjajevina [Sample c], respectively. The major constituent in Samples a and b , was oxygenated monoterpene, trans-sabinyl acetate (38.1% and 55.8% respectively). Monoterpene hydrocarbons, beta-pinene (13.5%) and santolinatriene (30.6%), were found to be the dominant components in Sample c. The toxic trans-sabinyl acetate was present only in traces in this sample. trans-Chrysanthenyl acetate, as one of major components in feverfew essential oil, has not been previously identified in the investigated essential oils.
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               Factor Part Location NP Content
 
Locality: Planinica, Montenegro
Aerial parts Montenegro
NP Content: <0.1 %
 
Locality: Sinjajevina, Montenegro
Aerial parts Montenegro
NP Content: 2.1 %
 
Locality: Visitor, Montenegro
Aerial parts Montenegro
NP Content: 0.4 %
References
1 Intraspecific Variation of Tanacetum larvatum Essential Oil