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ScientificNameLabel
Gamma-Damascenone-(E)
PHCD compound ID : 3076
Chemical Names :
Gamma-Damascenone-(E)
Molecular Formula : C13H18O1
Molecular Weight : 190.135765
More Details :
Names & Synonyms: 1-(6,6-dimethyl-2-methylene-cyclohex-3-en-1-yl)but-2-en-1-one , 1-(6,6-dimethyl-2-methylene-1-cyclohex-3-enyl)-2-buten-1-one , 1-(6,6-dimethyl-2-methylidenecyclohex-3-en-1-yl)but-2-en-1-one , 1-(6,6-dimethyl-2-methylidene-cyclohex-3-en-1-yl)but-2-en-1-one
Smiles: C/C=C/C(=O)[C@@H]1C(=C)C=CCC1(C)C
InChi : InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8,12H,2,9H2,1,3-4H3/b7-5+/t12-/m0/s1
InChi Key : InChIKey=NTFPXECSILEYKG-PZBABLGHSA-N
PubChem ID : 92630
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.092960
Hydrogen bond donor count : 0 Electric dipole moment : 1.869
XLogP : 3.612 VDW volume : 219.292192
Molecular weight : 190.135765 HOMO-LUMO gap : 9.125000
Herb list :
Refrences & Litretures:
  
397.      Journal:'International Journal of Pharmacology & Toxicology'      Year:'2015'      Volume:'5'      Page:'42'      DOI:''      Title:'CHEMICAL AND ANTIMICROBIAL PROPERTIES OF ESSENTIAL OILS OF Olea europea L'
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