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3,5,4 -trihydroxy-7,3'-dimethoxyflavanone
PHCD compound ID : 1995
Chemical Names :
3,5,4 -trihydroxy-7,3'-dimethoxyflavanone
Molecular Formula : C17H16O7
Molecular Weight : 332.089603
More Details :
Names & Synonyms:
Smiles: COc1cc2O[C@H](c3ccc(c(c3)OC)O)[C@H](C(=O)c2c(c1)O)O
InChi : InChI=1S/C17H16O7/c1-22-9-6-11(19)14-13(7-9)24-17(16(21)15(14)20)8-3-4-10(18)12(5-8)23-2/h3-7,16-19,21H,1-2H3/t16-,17+/m0/s1
InChi Key : InChIKey=DQZRHRLTSJNVBC-DLBZAZTESA-N
PubChem ID :
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 7 Ionization potential : 8.743036
Hydrogen bond donor count : 3 Electric dipole moment : 4.122
XLogP : 1.016 VDW volume : 286.795197
Molecular weight : 332.089603 HOMO-LUMO gap : 8.016000
Herb list :
Refrences & Litretures:
  
239.      Journal:'J. Agric. Food Chem'      Year:'2011'      Volume:'59'      Page:'11367'      DOI:'10.1021/jf202277w'      Title:'Artemisia dracunculus L. (Tarragon): A Critical Review of Its Traditional Use, Chemical Composition, Pharmacology, and Safety'
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