Sarsasapogenin

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Properties Simple | Detailed

Formula C27H44O3
IUPAC Name (1r,2s,4s,5's,6r,7s,8r,9s,12s,13s,16s,18r)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-tetrahydropyran]-16-ol
Molecular Mass 416.636 g·mol−1
Heat of Formation -852.6 ± 16.7 kJ·mol−1
Dipole Moment 1.91 ± 1.08 D
Volume 542.89 Å 3
Surface Area 413.86 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • (25s)-5beta-spirostan-3beta-ol
  • 5beta-spirostan-3beta-ol, (25s)- (8ci)
  • sarsapogenine
  • spirostan-3-ol, (3beta,5beta,25s)- (9ci)
CAS Number(s)
  • 126-19-2
InChIKey GMBQZIIUCVWOCD-WWASVFFGSA-N
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