Cas no 60325-74-8 ((+) pleiocarpamine)

(+) pleiocarpamine structure
(+) pleiocarpamine structure
Product Name:(+) pleiocarpamine
CAS No:60325-74-8
MF:C20H22N2O2
MW:322.400885105133
CID:2081674
PubChem ID:159880790
Update Time:2025-04-21

(+) pleiocarpamine Chemical and Physical Properties

Names and Identifiers

    • (+) pleiocarpamine
    • 1,16-cyclo-coryn-19-en-17-oic acid methyl ester
    • Pleiocarpamin
    • pleiocarpamine
    • 48B7VQ2JVV
    • 1,16-Cyclocorynan-17-oic acid, 19,20-didehydro-, methyl ester, (19E)-
    • (+)-16-epi-Pleiocarpamine
    • 2H-2,12-Methanoindolo(2,3-a)quinolizine-13-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (2S,3E,5S,12bS,13R)-
    • UNII-48B7VQ2JVV
    • 60325-74-8
    • 16-Epipleiocarpamine
    • Methyl (2S,3E,5S,12bS,13R)-3-ethylidene-1,3,4,6,7,12b-hexahydro-2H-2,12-methanoindolo[2,3-a]quinolizine-13-carboxylate
    • Methyl (2S,3E,5S,12bS,13R)-3-ethylidene-1,3,4,6,7,12b-hexahydro-2H-2,12-methanoindolo(2,3-a)quinolizine-13-carboxylate
    • Inchi: 1S/C20H22N2O2/c1-3-12-11-21-9-8-14-13-6-4-5-7-16(13)22-18(14)17(21)10-15(12)19(22)20(23)24-2/h3-7,15,17,19H,8-11H2,1-2H3/b12-3-/t15-,17-,19+/m0/s1
    • InChI Key: NTMOAQDHNZYZMZ-NOGYHVCNSA-N
    • SMILES: O(C)C([C@H]1[C@@H]2/C(=C\C)/CN3CCC4C5C=CC=CC=5N1C=4[C@@H]3C2)=O

Computed Properties

  • Exact Mass: 322.168127949g/mol
  • Monoisotopic Mass: 322.168127949g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 2
  • Complexity: 574
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.5
  • Topological Polar Surface Area: 34.5?2
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