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ScientificNameLabel
Isoplumbagin
PHCD compound ID : 2510
Chemical Names :
Isoplumbagin
Molecular Formula : C11H8O3
Molecular Weight : 188.047344
More Details :
Names & Synonyms: 8-hydroxy-2-methyl-naphthalene-1,4-dione , 8-hydroxy-2-methylnaphthalene-1,4-dione , 2-methyl-8-oxidanyl-naphthalene-1,4-dione , 8-hydroxy-2-methyl-1,4-naphthoquinone
Smiles: O=C1C=C(C)C(=O)c2c1cccc2O
InChi : InChI=1S/C11H8O3/c1-6-5-9(13)7-3-2-4-8(12)10(7)11(6)14/h2-5,12H,1H3
InChi Key : InChIKey=ZMOIGGHUSNHCAB-UHFFFAOYSA-N
PubChem ID : 375105
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.678663
Hydrogen bond donor count : 1 Electric dipole moment : 0.525
XLogP : 0.17 VDW volume : 173.7513
Molecular weight : 188.047344 HOMO-LUMO gap : 7.839000
Herb list :
Refrences & Litretures:
  
289.      Journal:'International Journal of Pharmaceutical Sciences and Drug Research'      Year:'2010'      Volume:'2'      Page:'91'      DOI:''      Title:'Lawsonia inermis Linnaeus: A Phytopharmacological Review'
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