Details of Natural Product (NP)

General Information of Natural Product (ID: NP0581)
  Natural Product Name
Oplopanone
  Synonyms
Oplopanone; 1911-78-0; 1-[[(1S,3AALPHA,7ABETA)-OCTAHYDRO-4BETA-HYDROXY-4-METHYL-7BETA-ISOPROPYL-1H-INDEN]-1-YL]ETHANONE; 1-[(1S,3aR,4R,7S,7aS)-4-hydroxy-4-methyl-7-propan-2-yl-1,2,3,3a,5,6,7,7a-octahydroinden-1-yl]ethanone; (-)-Oplopanone; CHEMBL4097977; DTXSID80172633; ZINC38918836; W2182
Click to Show/Hide
  Formula C15H26O2
  Weight 238.37
  Structure Could Not Find 2D Structure
3D Structure Download 2D Structure Download
  InChI InChI=1S/C15H26O2/c1-9(2)11-7-8-15(4,17)13-6-5-12(10(3)16)14(11)13/h9,11-14,17H,5-8H2,1-4H3/t11-,12+,13+,14+,15+/m0/s1
  InChI Key WLXJHVQYKOJBBN-NJVJYBDUSA-N
  Isomeric SMILES CC(C)[C@@H]1CC[C@@]([C@H]2[C@H]1[C@H](CC2)C(=O)C)(C)O
  Canonical SMILES CC(C)C1CCC(C2C1C(CC2)C(=O)C)(C)O
  External Links PubChem ID 10466745
CAS ID 1911-78-0
CHEMBL ID CHEMBL4097977
  NP Activity Charts   Click to show/hide
  Activity Info  

 The Content Variation of Natural Product Induced by Different Factor(s)
      Species Name: Pinus sylvestris
  Factor Name: Locality Variation [1]
              Species Info Factor Info
               Experiment Detail
The branches of pine were collected in July, 1996 in 15 different locations in Lithuania in the following regions: Western part (Silute, Jurbarkas, Kursiu Nerija), Eastern part (Salcininkai, Zarasai, Moletai), Southern part (Varena, Trakai, Radviliskis) and central part (Ukmerge, Jonava, Kaisiadorys). The branches in each location were collected from the trees in approximately 1 km radius.
Click to Show/Hide
               Factor Function
More than 70 constituents were identified (64 positively and 10 tentatively) in the oils. alpha-Pinene (18.5-33.0%) and delta-3-carene (9.1-24.6%) were dominating constituents with the only one exception when the germacrene-4-ol content in one of the samples was 13.2%. The important bornyl acetate content varied from 0.5% to 3.0%. The main sesquiterpenes were beta-caryophyllene, germacrene D, bicyclogermacrene, delta-cadinene, gamma-cadinene, germacrene D-4-ol, cubenol (2.0-5.1%) and alpha-cadinol (1.9-7.7%).
Click to Show/Hide
               Factor Part Location NP Content
 
Locality: Jurbarkas, Lithuania
 Branches Jurbarkas, Lithuania
NP Content: 0.1 %
 
Locality: Kaisiadorys, Lithuania
 Branches Kaisiadorys, Lithuania
NP Content: 0.05 %
 
Locality: Moletai, Lithuania
 Branches Moletai, Lithuania
NP Content: 0.05 %
 
Locality: Neringa (Smiltyne), Lithuania
 Branches Neringa (Smiltyne), Lithuania
NP Content: 0.1 %
 
Locality: Ukmerge, Lithuania
 Branches Ukmerge, Lithuania
NP Content: 0.05 %
 
Locality: Zarasai (Sunele), Lithuania
 Branches Zarasai (Sunele), Lithuania
NP Content: 0.1 %
References
1 Composition of Essential Oils of Pinus sylvestris L. from Different Locations of Lithuania