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ScientificNameLabel
perlolyrine
PHCD compound ID : 2438
Chemical Names :
perlolyrine
Molecular Formula : C16H12N2O2
Molecular Weight : 264.089878
More Details :
Names & Synonyms: [5-(9H-pyrido[3,4-b]indol-1-yl)-2-furyl]methanol , [5-(9H-pyrido[3,4-b]indol-1-yl)-2-furanyl]methanol , [5-(9H-pyrido[3,4-b]indol-1-yl)furan-2-yl]methanol , [5-(9H-$b-carbolin-1-yl)-2-furyl]methanol
Smiles: OCc1ccc(o1)c1nccc2c1[nH]c1c2cccc1
InChi : InChI=1S/C16H12N2O2/c19-9-10-5-6-14(20-10)16-15-12(7-8-17-16)11-3-1-2-4-13(11)18-15/h1-8,18-19H,9H2
InChi Key : InChIKey=KFUCYPGCMLPUMT-UHFFFAOYSA-N
PubChem ID : 160179
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.340847
Hydrogen bond donor count : 2 Electric dipole moment : 2.068
XLogP : 0.716 VDW volume : 210.748682
Molecular weight : 264.089878 HOMO-LUMO gap : 7.420000
Herb list :
Refrences & Litretures:
  
277.      Journal:'Drug Discoveries & Therapeutics'      Year:'2015'      Volume:'9'      Page:'23'      DOI:'10.5582/ddt.2015.01004'      Title:'Chemical constituents and bioactivities of Panax ginseng (C. A. Mey.)'
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