(3R,5R,6S,7R,8R,11R,12R,13R,14S,15S)-6,12,14-Trihydroxy-5,7,8,11,13,15-Hexamethyl-1,9-Dioxaspiro[2.13]Hexadecane-4,10-Dione

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Properties Simple | Detailed

Formula C20H34O7
IUPAC Name (3r,5s,6s,7r,8r,9r,12r,13r,14s,15r)-6,8,14-trihydroxy-5,7,9,12,13,15-hexamethyl-1,11-dioxaspiro[2.13]hexadecane-10,16-dione
Molecular Mass 386.480 g·mol−1
Heat of Formation -1380.6 ± 16.7 kJ·mol−1
Dipole Moment 2.70 ± 1.08 D
Volume 478.56 Å 3
Surface Area 348.08 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy 0.57 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-oleandolide
  • (3r,5s,6s,7r,8r,9r,12r,13r,14s,15r)-6,8,14-trihydroxy-5,7,9,12,13,15-hexamethyl-1,11-dioxaspiro[2.13]hexadecane-10,16-quinone
  • (3r-(3r*,5r*,6s*,7r*,8r*,11r*,12s*,13r*,14s*,15s*))-6,12,14-trihydroxy-5,7,8,11,13,15-hexamethyl-1,9-dioxaspiro(2.13)hexadecane-4,10-dione
  • 1,9-dioxaspiro(2,13)hexadecane, oleandolide deriv.
  • 1,9-dioxaspiro(2.13)hexadecane-4,10-dione, 6,12,14-trihydroxy-5,7,8,11,13,15-hexamethyl-, (3r-(3r*,5r*,6s*,7r*,8r*,11r*,12s*,13r*,14s*,15s*))-
  • oleandomycin aglycone
  • oleandonolide
InChIKey PFDLUBNRHMFBGI-WNFDIZNISA-N
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