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ScientificNameLabel
6-demethoxycapillarisin
PHCD compound ID : 2020
Chemical Names :
6-demethoxycapillarisin
Molecular Formula : C15H10O6
Molecular Weight : 286.047738
More Details :
Names & Synonyms: 5,7-dihydroxy-2-(4-hydroxyphenoxy)chromen-4-one , 5,7-dihydroxy-2-(4-hydroxyphenoxy)-1-benzopyran-4-one , 5,7-bis(oxidanyl)-2-(4-oxidanylphenoxy)chromen-4-one , 5,7-dihydroxy-2-(4-hydroxyphenoxy)chromone
Smiles: Oc1ccc(cc1)Oc1cc(=O)c2c(o1)cc(cc2O)O
InChi : InChI=1S/C15H10O6/c16-8-1-3-10(4-2-8)20-14-7-12(19)15-11(18)5-9(17)6-13(15)21-14/h1-7,16-18H
InChi Key : InChIKey=UBSCDKPKWHYZNX-UHFFFAOYSA-N
PubChem ID : 5316511
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 9.497377
Hydrogen bond donor count : 3 Electric dipole moment : 5.480
XLogP : 1.565 VDW volume : 240.776543
Molecular weight : 286.047738 HOMO-LUMO gap : 9.008000
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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