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ScientificNameLabel
Pelargonidin
PHCD compound ID : 4427
Chemical Names :
Pelargonidin
Molecular Formula : C15H11O5
Molecular Weight : 271.060648
More Details :
Names & Synonyms: 2-(4-hydroxyphenyl)chromenylium-3,5,7-triol , 2-(4-hydroxyphenyl)-1-benzopyrylium-3,5,7-triol
Smiles: Oc1ccc(cc1)c1[o+]c2cc(O)cc(c2cc1O)O
InChi : InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7H,(H3-,16,17,18,19)/p+1
InChi Key : InChIKey=XVFMGWDSJLBXDZ-UHFFFAOYSA-O
PubChem ID : 440832
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 12.651704
Hydrogen bond donor count : 4 Electric dipole moment : 1.364
XLogP : 1.619 VDW volume : 222.404545
Molecular weight : 271.060648 HOMO-LUMO gap : 6.748000
Herb list :
Refrences & Litretures:
  
658.      Journal:'Journal of Ethnopharmacology'      Year:'2007'      Volume:'109'      Page:'177'      DOI:'10.1016/j.jep.2006.09.006'      Title:'Punica granatum (pomegranate) and its potential for prevention and treatment of in?ammation and cancer'
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