Ailanthone

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Properties Simple | Detailed

Formula C20H24O7
IUPAC Name ailanthone
Molecular Mass 376.400 g·mol−1
Heat of Formation -1148.4 ± 16.7 kJ·mol−1
Dipole Moment 7.52 ± 1.08 D
Volume 415.13 Å 3
Surface Area 314.55 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1,11c-(epoxymethano)phenanthro(10,1-bc)pyran-5,10(3h,6ah)-dione, 1,3a,4,7,7a,11,11a,11b-octahydro-8,11a-beta-dimethyl-3-methylene-1-alpha,2-beta,11-beta-trihydroxy-
  • ailanthone (7ci)
  • ailantone
  • picrasa-3,13(21)-dien-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1.beta.,11.beta.,12.alpha.)
  • picrasa-3,13(21)-diene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1-beta,11-beta,12-alpha)-
  • picrasa-3,13(21)-diene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1beta,11beta,12alpha)-
CAS Number(s)
  • 981-15-7
InChIKey WBBVXGHSWZIJST-RLQYZCPESA-N
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