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ScientificNameLabel
16-Octadecenal
PHCD compound ID : 1267
Chemical Names :
16-Octadecenal , (16E)-Octadecenal
Molecular Formula : C18H34O1
Molecular Weight : 266.260966
More Details :
Names & Synonyms: (E)-octadec-16-enal , (E)-16-octadecenal
Smiles: O=CCCCCCCCCCCCCCC/C=C/C
InChi : InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-3,18H,4-17H2,1H3/b3-2+
InChi Key : InChIKey=WTQUVMLIINDJCS-NSCUHMNNSA-N
PubChem ID : 5367668
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 9.547635
Hydrogen bond donor count : 0 Electric dipole moment : 2.795
XLogP : 8.711 VDW volume : 323.401491
Molecular weight : 266.260966 HOMO-LUMO gap : 10.266000
Herb list :
Refrences & Litretures:
  
132.      Journal:'Phytother. Res'      Year:'2007'      Volume:'21'      Page:'427'      DOI:'10.1002/ptr.2077'      Title:'In vitro Activities of Citrus medica L. cv. Diamante (Diamante citron) relevant to Treatment of Diabetes and Alzheimer’s disease'
634.      Journal:'Chemistry of Natural Compounds'      Year:'2009'      Volume:'45'      Page:'110'      DOI:''      Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF Rosa damascena FROM TWO DIFFERENT LOCATIONS IN IRAN'
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