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ScientificNameLabel
Tryptanthrin
PHCD compound ID : 4731
Chemical Names :
Tryptanthrin , Tryptanthrine
Molecular Formula : C15H8N2O2
Molecular Weight : 248.058577
More Details :
Names & Synonyms: indolo[2,1-b]quinazoline-6,12-dione , indolo[2,1-b]quinazoline-6,12-quinone
Smiles: O=C1c2nc3ccccc3c(=O)n2c2c1cccc2
InChi : InChI=1S/C15H8N2O2/c18-13-10-6-2-4-8-12(10)17-14(13)16-11-7-3-1-5-9(11)15(17)19/h1-8H
InChi Key : InChIKey=VQQVWGVXDIPORV-UHFFFAOYSA-N
PubChem ID : 73549
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.338458
Hydrogen bond donor count : 0 Electric dipole moment : 1.882
XLogP : 0.446 VDW volume : 212.616239
Molecular weight : 248.058577 HOMO-LUMO gap : 7.657000
Herb list :
Refrences & Litretures:
  
750.      Journal:'Phytochemistry'      Year:'2009'      Volume:'70'      Page:'924'      DOI:'10.1016/j.phytochem.2009.04.019'      Title:'A comprehensive metabolite profiling of Isatis tinctoria leaf extracts'
751.      Journal:'Phytothérapie'      Year:'2012'      Volume:'10'      Page:'238'      DOI:'10.1007/s10298-012-0717-y'      Title:'Isatis tinctoria L. Brassicaceae : le pastel des teinturiers'
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