(25R)-5A-Spirostan-3B-Ol

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Properties Simple | Detailed

Formula C27H44O3
IUPAC Name (25r)-5a-spirostan-3b-ol
Molecular Mass 416.636 g·mol−1
Heat of Formation -874.3 ± 16.7 kJ·mol−1
Dipole Moment 1.77 ± 1.08 D
Volume 541.1 Å 3
Surface Area 416.88 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 2.54 ± eV
Point Group Symmetry C1
Synonyms
  • spirostan-3-ol, (3beta,5alpha,25s)-
CAS Number(s)
  • 77-60-1
InChIKey GMBQZIIUCVWOCD-MFRNJXNGSA-N
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Elements H C O