Sophocarpine

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Properties Simple | Detailed

Formula C15H22N2O
IUPAC Name (1r,2r,9s,13s,17s)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-6-one
Molecular Mass 246.348 g·mol−1
Heat of Formation -141.2 ± 16.7 kJ·mol−1
Dipole Moment 6.02 ± 1.08 D
Volume 304.62 Å 3
Surface Area 257.23 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 0.20 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-(7as,13ar,13br,13cs)-2,3,6,7,7a,8,13,13a,13b,13c-decahydro-1h,5h,10h-dipyrido[2,1-f:3,2,1-ij][1,6]naphthyridin-10-one
  • (-)-sophocarpine
  • 13,14-didehydromatridin-15-one
  • 145572-44-7 (monohydrate)
  • 1h,5h,10h-dipyrido(2,1-f:3',2',1'-ij)(1,6)naphthyridin-10-one, 2,3,6,7,7a,8,13,13a,13b,13c-decahydro-, (7as,13ar,13br,13cs)-
  • bb_nc-1020
  • matridin-15-one, 13,14-didehydro- (9ci)
InChIKey AAGFPTSOPGCENQ-JLNYLFASSA-N
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