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ScientificNameLabel
norartocarpetin
PHCD compound ID : 3450
Chemical Names :
norartocarpetin
Molecular Formula : C15H10O6
Molecular Weight : 286.047738
More Details :
Names & Synonyms: 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one , 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-1-benzopyran-4-one , 2-(2,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one , 2-[2,4-bis(oxidanyl)phenyl]-5,7-bis(oxidanyl)chromen-4-one , 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-chromone
Smiles: Oc1ccc(c(c1)O)c1cc(=O)c2c(o1)cc(cc2O)O
InChi : InChI=1S/C15H10O6/c16-7-1-2-9(10(18)3-7)13-6-12(20)15-11(19)4-8(17)5-14(15)21-13/h1-6,16-19H
InChi Key : InChIKey=ZSYPIPFQOQGYHH-UHFFFAOYSA-N
PubChem ID : 5481970
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 6 Ionization potential : 9.269184
Hydrogen bond donor count : 4 Electric dipole moment : 5.027
XLogP : 1.057 VDW volume : 240.776543
Molecular weight : 286.047738 HOMO-LUMO gap : 8.305000
Herb list :
Refrences & Litretures:
  
482.      Journal:'J. Agric. Food Chem'      Year:'2010'      Volume:'58'      Page:'5368'      DOI:'10.1021/jf1003607'      Title:'Tyrosinase Inhibitory Constituents from the Roots of Morus nigra: A Structure-Activity Relationship Study'
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