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ScientificNameLabel
Ellagic acid rhamnosyl
PHCD compound ID : 5564
Chemical Names :
Ellagic acid rhamnosyl
Molecular Formula : C20H16O12
Molecular Weight : 448.064176
More Details :
Names & Synonyms:
Smiles: O[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1O)O)C)Oc1cc2c(=O)oc3c4c2c(c1O)oc(=O)c4cc(c3O)O
InChi : InChI=1S/C20H16O12/c1-4-11(22)14(25)15(26)20(29-4)30-8-3-6-10-9-5(18(27)32-17(10)13(8)24)2-7(21)12(23)16(9)31-19(6)28/h2-4,11,14-15,20-26H,1H3/t4-,11-,14+,15-,20+/m1/s1
InChi Key : InChIKey=NLOYJHDXNPMFKW-IUCPOWOASA-N
PubChem ID :
Rotatable bond count : 2 Rule of five : 2
Hydrogen bond acceptor count : 12 Ionization potential : 9.305258
Hydrogen bond donor count : 6 Electric dipole moment : 3.634
XLogP : 0.334 VDW volume : 355.284909
Molecular weight : 448.064176 HOMO-LUMO gap : 7.660000
Herb list :
Refrences & Litretures:
  
942.      Journal:'Molecules'      Year:'2018'      Volume:'23'      Page:'1247'      DOI:'10.3390/molecules23061247'      Title:'Exploring New Antioxidant and Mineral Compounds from Nymphaea alba Wild-Grown in Danube Delta Biosphere'
943.      Journal:'BMC Complementary and Alternative Medicine'      Year:'2017'      Volume:'17'      Page:'52'      DOI:'10.1186/s12906-017-1561-2'      Title:'Profile of bioactive compounds in Nymphaea alba L. leaves growing in Egypt: hepatoprotective, antioxidant and anti-inflammatory activity'
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