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ScientificNameLabel
kojic acid
PHCD compound ID : 3465
Chemical Names :
kojic acid
Molecular Formula : C6H6O4
Molecular Weight : 142.026609
More Details :
Names & Synonyms: 5-hydroxy-2-(hydroxymethyl)pyran-4-one , 5-hydroxy-2-(hydroxymethyl)-4-pyranone , 2-(hydroxymethyl)-5-oxidanyl-pyran-4-one , 5-hydroxy-2-methylol-pyran-4-one
Smiles: OCc1occ(c(=O)c1)O
InChi : InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2
InChi Key : InChIKey=BEJNERDRQOWKJM-UHFFFAOYSA-N
PubChem ID : 3840
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.533918
Hydrogen bond donor count : 2 Electric dipole moment : 5.184
XLogP : -0.13 VDW volume : 127.227438
Molecular weight : 142.026609 HOMO-LUMO gap : 8.894000
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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