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ScientificNameLabel
Papaverrubine B
PHCD compound ID : 3585
Chemical Names :
Papaverrubine B
Molecular Formula : C21H23N1O6
Molecular Weight : 385.152537
More Details :
Names & Synonyms:
Smiles: CO[C@H]1O[C@H]2c3cc(OC)c(cc3CCN[C@@H]2c2c1c1OCOc1cc2)OC
InChi : InChI=1S/C21H23NO6/c1-23-15-8-11-6-7-22-18-12-4-5-14-20(27-10-26-14)17(12)21(25-3)28-19(18)13(11)9-16(15)24-2/h4-5,8-9,18-19,21-22H,6-7,10H2,1-3H3/t18-,19+,21+/m1/s1
InChi Key : InChIKey=JEUAVYPZVKRQOZ-DYXWJJEUSA-N
PubChem ID : 12309624
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 7 Ionization potential : 8.679608
Hydrogen bond donor count : 1 Electric dipole moment : 2.243
XLogP : 1.139 VDW volume : 336.109211
Molecular weight : 385.152537 HOMO-LUMO gap : 8.610000
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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