(3R,4S,5R,6S,7S,9R,11R,12S,13R,14R)-4,6,12-Trihydroxy-3,5,7,9,11,13,14-Heptamethyloxacyclotetradecane-2,10-Dione

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Properties Simple | Detailed

Formula C20H36O6
IUPAC Name (3r,4s,5r,6s,7s,9r,11r,12s,13r,14r)-4,6,12-trihydroxy-3,5,7,9,11,13,14-heptamethyl-oxacyclotetradecane-2,10-dione
Molecular Mass 372.496 g·mol−1
Heat of Formation -1396.5 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 479.0 Å 3
Surface Area 352.7 Å 2
HOMO Energy -10.05 ± 0.55 eV
LUMO Energy 0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s,5r,6s,7s,9r,11r,12s,13r,14r)-4,6,12-trihydroxy-3,5,7,9,11,13,14-heptamethyl-1-oxacyclotetradecane-2,10-dione
  • (3r,4s,5r,6s,7s,9r,11r,12s,13r,14r)-4,6,12-trihydroxy-3,5,7,9,11,13,14-heptamethyl-1-oxacyclotetradecane-2,10-quinone
  • 8,8a-deoxyoleandolide
  • 8-methyloleandolide
  • erythronolide a, 13-deethyl-6,12-dideoxy-13-methyl-
  • lmpk01000034
CAS Number(s)
  • 53428-54-9
InChIKey OLPAVFVRSHWADO-KYEFFAPUSA-N
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