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ScientificNameLabel
heneicosanoic acid
PHCD compound ID : 1823
Chemical Names :
heneicosanoic acid
Molecular Formula : C21H42O2
Molecular Weight : 326.318481
More Details :
Names & Synonyms: henicosanoic acid , heneicosanoic acid
Smiles: CCCCCCCCCCCCCCCCCCCCC(=O)O
InChi : InChI=1S/C21H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3,(H,22,23)
InChi Key : InChIKey=CKDDRHZIAZRDBW-UHFFFAOYSA-N
PubChem ID : 16898
Rotatable bond count : 19 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 10.754829
Hydrogen bond donor count : 1 Electric dipole moment : 4.901
XLogP : 10.415 VDW volume : 386.716131
Molecular weight : 326.318481 HOMO-LUMO gap : 11.806000
Herb list :
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'
291.      Journal:'Food and Bioproducts Processing'      Year:'2012'      Volume:'90'      Page:'87'      DOI:'10.1016/j.fbp.2011.02.010'      Title:'Optimization of enzymatic pretreatment for n-hexane extraction of oil from Silybum marianum seeds using response surface methodology'
298.      Journal:'Analytical Chemistry Letters'      Year:'2012'      Volume:'2'      Page:'363'      DOI:'10.1080/22297928.2012.10662621'      Title:'Chemical Composition of Fatty Acid from Different Parts of Descurainia Sophia L. Growing Wild in North of Iran'
652.      Journal:'Research Journal of Pharmaceutical, Biological and Chemical Sciences'      Year:'2015'      Volume:'6'      Page:'125'      DOI:''      Title:'Volatile Oil Composition of Carthamus Tinctorius L the Flowers Grown in Kazakhstan'
713.      Journal:'Trends in Phramaceutical Sciences'      Year:'2016'      Volume:'2'      Page:'77'      DOI:''      Title:'Phytochemical assessments of Astragalus hamosus pods (Iklil-ul-Malik)'
913.      Journal:'Research Journal of Pharmacognosy'      Year:'2018'      Volume:'5'      Page:'31'      DOI:'10.22127/rjp.2018.64870'      Title:'Pharmacognostic and Anti-Inflammatory Properties of Securigera securidaca Seeds and Seed Oil'
956.      Journal:'Research Journal of Pharmacognosy'      Year:'2018'      Volume:'5'      Page:'31'      DOI:'10.22127/rjp.2018.64870'      Title:'Chemical composition and antibacterial activity of methanolic extract from Echinops robustus on typical food-borne pathogens'
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