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14-Hydroxyartonin E
PHCD compound ID : 3285
Chemical Names :
14-Hydroxyartonin E
Molecular Formula : C25H25O8
Molecular Weight : 453.154943
More Details :
Names & Synonyms:
Smiles: OC/C(=C\Cc1c(oc2c(c1=O)c(O)cc1c2C=CC([OH+]1)(C)C)c1cc(O)c(cc1O)O)/C
InChi : InChI=1S/C25H24O8/c1-12(11-26)4-5-14-22(31)21-19(30)10-20-13(6-7-25(2,3)33-20)24(21)32-23(14)15-8-17(28)18(29)9-16(15)27/h4,6-10,26-30H,5,11H2,1-3H3/p+1/b12-4-
InChi Key : InChIKey=UTYRRYOOGHLXNT-QCDXTXTGSA-O
PubChem ID :
Rotatable bond count : 4 Rule of five : 1
Hydrogen bond acceptor count : 8 Ionization potential : 10.961866
Hydrogen bond donor count : 6 Electric dipole moment : 18.913
XLogP : 0 VDW volume : 0
Molecular weight : 453.154943 HOMO-LUMO gap : 5.776000
Herb list :
Refrences & Litretures:
  
446.      Journal:'American Journal of Analytical Chemistry'      Year:'2011'      Volume:'2'      Page:'871'      DOI:'10.4236/ajac.2011.28100'      Title:'Extraction, Identification and Antioxidative Properties of the Flavonoid-Rich Fractions from Leaves and Flowers of Cassia angustifolia'
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