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eicosenoic acid
ScientificNameLabel
eicosenoic acid
PHCD compound ID :
1820
Chemical Names :
eicosenoic acid
Molecular Formula :
C20H38O2
Molecular Weight :
310.28718
More Details :
Names & Synonyms:
(E)-icos-11-enoic acid , (E)-11-eicosenoic acid , (E)-eicos-11-enoic acid
Smiles:
CCCCCCCC/C=C/CCCCCCCCCC(=O)O
InChi :
InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10H,2-8,11-19H2,1H3,(H,21,22)/b10-9+
InChi Key :
InChIKey=BITHHVVYSMSWAG-MDZDMXLPSA-N
PubChem ID :
5282769
Rotatable bond count :
17
Rule of five :
2
Hydrogen bond acceptor count :
2
Ionization potential :
9.574319
Hydrogen bond donor count :
1
Electric dipole moment :
4.311
XLogP :
9.33
VDW volume :
366.783687
Molecular weight :
310.28718
HOMO-LUMO gap :
10.556000
Herb list :
High mallow, Marsh mallow, Wild mallow - Malva sylvestris - پنیرک قرمز، پنیرک
Musk melon, Sweet melon - Cucumis melo - خربزه، خربزه وحشی
Woad - Isatis tinctoria - وسمه
Refrences & Litretures:
209. Journal:'Food and Chemical Toxicology' Year:'2010' Volume:'48' Page:'1466' DOI:'10.1016/j.fct.2010.03.012' Title:'Leaves, ?owers, immature fruits and leafy ?owered stems of Malva sylvestris: A comparative study of the nutraceutical potential and composition'
517. Journal:'J Food Sci Technol' Year:'2015' Volume:'52' Page:'8172' DOI:'10.1007/s13197-015-1889-x' Title:'Oxidative stability, chemical composition and organoleptic properties of seinat (Cucumis melo var. tibish) seed oil blends with peanut oil from China'
518. Journal:'Grasas Aceites' Year:'2014' Volume:'65' Page:'e008' DOI:'10.3989/gya.074913' Title:'Physicochemical properties and chemical composition of Seinat (Cucumis melo var. tibish) seed oil and its antioxidant activity'
750. Journal:'Phytochemistry' Year:'2009' Volume:'70' Page:'924' DOI:'10.1016/j.phytochem.2009.04.019' Title:'A comprehensive metabolite profiling of Isatis tinctoria leaf extracts'
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