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ScientificNameLabel
Northebaine
PHCD compound ID : 3571
Chemical Names :
Northebaine
Molecular Formula : C18H19N1O3
Molecular Weight : 297.136493
More Details :
Names & Synonyms: (4R,7aR,12bS)-7,9-dimethoxy-1,2,3,4,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline
Smiles: COC1=CC=C2[C@@]34[C@H]1Oc1c4c(C[C@H]2NCC3)ccc1OC
InChi : InChI=1S/C18H19NO3/c1-20-13-5-3-10-9-12-11-4-6-14(21-2)17-18(11,7-8-19-12)15(10)16(13)22-17/h3-6,12,17,19H,7-9H2,1-2H3/t12-,17+,18+/m1/s1
InChi Key : InChIKey=QKQQEIVDLRUZRP-UUWFMWQGSA-N
PubChem ID : 10881027
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.335046
Hydrogen bond donor count : 1 Electric dipole moment : 0.988
XLogP : 1.025 VDW volume : 271.387035
Molecular weight : 297.136493 HOMO-LUMO gap : 8.417000
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'
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