Skip Navigation Links
ScientificNameLabel
Gamma-Damascone-(E)
PHCD compound ID : 3077
Chemical Names :
Gamma-Damascone-(E)
Molecular Formula : C13H20O1
Molecular Weight : 192.151415
More Details :
Names & Synonyms: (E)-1-[(1R)-2,2-dimethyl-6-methylene-cyclohexyl]but-2-en-1-one , (E)-1-[(1R)-2,2-dimethyl-6-methylenecyclohexyl]-2-buten-1-one , (E)-1-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]but-2-en-1-one , (E)-1-[(1R)-2,2-dimethyl-6-methylidene-cyclohexyl]but-2-en-1-one
Smiles: C/C=C/C(=O)[C@H]1C(=C)CCCC1(C)C
InChi : InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7,12H,2,6,8-9H2,1,3-4H3/b7-5+/t12-/m1/s1
InChi Key : InChIKey=IXLLBXDECOMIBP-HOSRBBHYSA-N
PubChem ID : 10104051
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.459643
Hydrogen bond donor count : 0 Electric dipole moment : 2.186
XLogP : 3.726 VDW volume : 221.928651
Molecular weight : 192.151415 HOMO-LUMO gap : 9.491000
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'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us