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ScientificNameLabel
(+)-Isothebaine
PHCD compound ID : 3572
Chemical Names :
(+)-Isothebaine
Molecular Formula : C19H21N1O3
Molecular Weight : 311.152144
More Details :
Names & Synonyms: 2,11-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1-ol
Smiles: COc1cc2CCN([C@@H]3c2c(c1O)c1c(OC)cccc1C3)C
InChi : InChI=1S/C19H21NO3/c1-20-8-7-12-10-15(23-3)19(21)18-16(12)13(20)9-11-5-4-6-14(22-2)17(11)18/h4-6,10,13,21H,7-9H2,1-3H3/t13-/m0/s1
InChi Key : InChIKey=RQCOQZNIQLKGTN-ZDUSSCGKSA-N
PubChem ID : 324708
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.230946
Hydrogen bond donor count : 1 Electric dipole moment : 3.307
XLogP : 1.407 VDW volume : 287.50302
Molecular weight : 311.152144 HOMO-LUMO gap : 8.092000
Herb list :
Refrences & Litretures:
  
501.      Journal:'Journal of Medicinal Plants'      Year:'2015'      Volume:'14'      Page:'6'      DOI:''      Title:'A Systematic Review on Main Chemical Constituents of Papaver bracteatum'
502.      Journal:'Journal of Ethnopharmacology'      Year:'1981'      Volume:'3'      Page:'21'      DOI:''      Title:'BIOLOGICAL ACTIVITY OF THE ALKALOIDS OF PAPAVER BRACTEATUM LINDL'
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