Skip Navigation Links
ScientificNameLabel
pratensein
PHCD compound ID : 2544
Chemical Names :
pratensein
Molecular Formula : C16H12O6
Molecular Weight : 300.063388
More Details :
Names & Synonyms: 5,7-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)chromen-4-one , 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)-1-benzopyran-4-one , 5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one , 3-(4-methoxy-3-oxidanyl-phenyl)-5,7-bis(oxidanyl)chromen-4-one , 5,7-dihydroxy-3-(3-hydroxy-4-methoxy-phenyl)chromone
Smiles: COc1ccc(cc1O)c1coc2c(c1=O)c(O)cc(c2)O
InChi : InChI=1S/C16H12O6/c1-21-13-3-2-8(4-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
InChi Key : InChIKey=FPIOBTBNRZPWJW-UHFFFAOYSA-N
PubChem ID : 5281803
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 8.767961
Hydrogen bond donor count : 3 Electric dipole moment : 3.232
XLogP : 1.283 VDW volume : 258.072527
Molecular weight : 300.063388 HOMO-LUMO gap : 8.036000
Herb list :
Refrences & Litretures:
  
294.      Journal:'International Journal of Herbal Medicine'      Year:'2014'      Volume:'2'      Page:'47'      DOI:''      Title:'Alhagi pseudalhagi: a review of its phyto-chemistry, pharmacology, folklore claims and Ayurvedic studies'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us