Cas no 51105-10-3 ((-)-Porantherilidine)

(-)-Porantherilidine structure
(-)-Porantherilidine structure
Product Name:(-)-Porantherilidine
CAS No:51105-10-3
MF:C22H33NO2
MW:343.502926588058
CID:2053428
Update Time:2025-04-21

(-)-Porantherilidine Chemical and Physical Properties

Names and Identifiers

    • (±)-Porantherilidine
    • Porantherilidin
    • (-)-Porantherilidine
    • (αR,4S,9aβ)-Octahydro-6α-methyl-α-propyl-2H-quinolizine-4-ethanol benzoate
    • Inchi: 1S/C22H33NO2/c1-3-9-21(25-22(24)18-11-5-4-6-12-18)16-20-15-8-14-19-13-7-10-17(2)23(19)20/h4-6,11-12,17,19-21H,3,7-10,13-16H2,1-2H3
    • InChI Key: IGRSTMLFLWBIPT-UHFFFAOYSA-N
    • SMILES: CCCC(OC(C1C=CC=CC=1)=O)CC1N2C(CCCC2C)CCC1

Computed Properties

  • Exact Mass: 343.251
  • Monoisotopic Mass: 343.251
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 7
  • Complexity: 418
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 29.5A^2
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