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ScientificNameLabel
Luteolin 3'-O-beta-xylopyranoside
PHCD compound ID : 4425
Chemical Names :
Luteolin 3'-O-beta-xylopyranoside
Molecular Formula : C20H18O10
Molecular Weight : 418.089997
More Details :
Names & Synonyms: 5,7-dihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-phenyl]chromen-4-one , 5,7-dihydroxy-2-[4-hydroxy-3-[[(2S,3R,4S,5R)-3,4,5-trihydroxy-2-oxanyl]oxy]phenyl]-1-benzopyran-4-one , 5,7-dihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]chromen-4-one , 5,7-bis(oxidanyl)-2-[4-oxidanyl-3-[(2S,3R,4S,5R)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-phenyl]chromen-4-one , 5,7-dihydroxy-2-[4-hydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-phenyl]chromone
Smiles: Oc1cc(O)c2c(c1)oc(cc2=O)c1ccc(c(c1)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O
InChi : InChI=1S/C20H18O10/c21-9-4-11(23)17-12(24)6-14(29-16(17)5-9)8-1-2-10(22)15(3-8)30-20-19(27)18(26)13(25)7-28-20/h1-6,13,18-23,25-27H,7H2/t13-,18+,19-,20+/m1/s1
InChi Key : InChIKey=ZUMPYZVELBOZDM-RHMWYWNKSA-N
PubChem ID : 101675298
Rotatable bond count : 3 Rule of five : 1
Hydrogen bond acceptor count : 10 Ionization potential : 9.310199
Hydrogen bond donor count : 6 Electric dipole moment : 4.228
XLogP : -0.006 VDW volume : 350.060914
Molecular weight : 418.089997 HOMO-LUMO gap : 8.202000
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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