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ScientificNameLabel
Tetrahydroharmine
PHCD compound ID : 58
Chemical Names :
Tetrahydroharmine
Molecular Formula : C13H16N2O1
Molecular Weight : 216.126263
More Details :
Names & Synonyms: (1R)-7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole , (1R)-7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-$b-carboline
Smiles: COc1ccc2c(c1)[nH]c1c2CCN[C@@H]1C
InChi : InChI=1S/C13H16N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7-8,14-15H,5-6H2,1-2H3/t8-/m1/s1
InChi Key : InChIKey=ZXLDQJLIBNPEFJ-MRVPVSSYSA-N
PubChem ID : 442118
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 8.013089
Hydrogen bond donor count : 2 Electric dipole moment : 3.621
XLogP : 1.301 VDW volume : 194.772795
Molecular weight : 216.126263 HOMO-LUMO gap : 8.169000
Herb list :
Refrences & Litretures:
  
3.      Journal:'Pharmacognosy Reviews'      Year:'2013'      Volume:'7'      Page:'199'      DOI:'10.4103/0973-7847.120524'      Title:'Pharmacological and therapeutic effects of Peganum harmala and its main alkaloids'
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