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ScientificNameLabel
trans gamma-Cadinene
PHCD compound ID : 177
Chemical Names :
trans gamma-Cadinene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: (5R)-5-isopropyl-8-methyl-3-methylene-2,4,4a,5,6,8a-hexahydro-1H-naphthalene , (5R)-8-methyl-3-methylene-5-propan-2-yl-2,4,4a,5,6,8a-hexahydro-1H-naphthalene , (5R)-8-methyl-3-methylidene-5-propan-2-yl-2,4,4a,5,6,8a-hexahydro-1H-naphthalene
Smiles: C=C1CC[C@H]2[C@@H](C1)[C@H](CC=C2C)C(C)C
InChi : InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h6,10,13-15H,3,5,7-9H2,1-2,4H3/t13-,14-,15+/m1/s1
InChi Key : InChIKey=COEMCKKNQLRLNH-KFWWJZLASA-N
PubChem ID : 6429304
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.120515
Hydrogen bond donor count : 0 Electric dipole moment : 0.928
XLogP : 5.946 VDW volume : 238.010393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.498000
Herb list :
Refrences & Litretures:
  
9.      Journal:'Food Chemistry'      Year:'2009'      Volume:'112'      Page:'1072'      DOI:'10.1016/j.foodchem.2008.07.015'      Title:'Flavour compounds of Lavandula angustifolia L. to use in food manufacturing: Comparison of three different extraction methods'
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