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ScientificNameLabel
alpha-dehydro-ar-himachalene
PHCD compound ID : 4603
Chemical Names :
alpha-dehydro-ar-himachalene
Molecular Formula : C15H20
Molecular Weight : 200.156501
More Details :
Names & Synonyms: 3,5,5-trimethyl-9-methylene-7,8-dihydro-6H-benzo[7]annulene , 3,5,5-trimethyl-9-methylidene-7,8-dihydro-6H-benzo[7]annulene , 3,5,5-trimethyl-9-methylene-7,8-dihydro-6H-benzocycloheptene
Smiles: Cc1ccc2c(c1)C(C)(C)CCCC2=C
InChi : InChI=1S/C15H20/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h7-8,10H,2,5-6,9H2,1,3-4H3
InChi Key : InChIKey=LLYOXWSLVUQJHF-UHFFFAOYSA-N
PubChem ID : 15098633
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 8.901503
Hydrogen bond donor count : 0 Electric dipole moment : 1.250
XLogP : 5.617 VDW volume : 221.837476
Molecular weight : 200.156501 HOMO-LUMO gap : 9.226000
Herb list :
Refrences & Litretures:
  
714.      Journal:'African Journal of Biotechnology'      Year:'2010'      Volume:'9'      Page:'2709'      DOI:''      Title:'Phenols, essential oils and carotenoids of Rosa canina from Tunisia and their antioxidant activities'
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