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ScientificNameLabel
davidigenin
PHCD compound ID : 1997
Chemical Names :
davidigenin
Molecular Formula : C15H14O4
Molecular Weight : 258.089209
More Details :
Names & Synonyms: 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-one , 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-1-propanone , 1-[2,4-bis(oxidanyl)phenyl]-3-(4-hydroxyphenyl)propan-1-one
Smiles: Oc1ccc(cc1)CCC(=O)c1ccc(cc1O)O
InChi : InChI=1S/C15H14O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-2,4-7,9,16-17,19H,3,8H2
InChi Key : InChIKey=UDGKKUWYNITJRX-UHFFFAOYSA-N
PubChem ID : 442342
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.137684
Hydrogen bond donor count : 3 Electric dipole moment : 2.380
XLogP : 1.455 VDW volume : 238.189007
Molecular weight : 258.089209 HOMO-LUMO gap : 8.399000
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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