(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-22-(2-Hydroxy-2-Propanyl)-3,8,8,17,19-Pentamethyl-23,24-Dioxaheptacyclo[19.2.1.0~1,18~.0~3,17~.0~4,14~.0~7,12~.0~12,14~]Tetracosane-2,9-Diol

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Properties Simple | Detailed

Formula C30H48O5
IUPAC Name cimigenol
Molecular Mass 488.699 g·mol−1
Heat of Formation -1113.5 ± 16.7 kJ·mol−1
Dipole Moment 5.22 ± 1.08 D
Volume 610.48 Å 3
Surface Area 441.76 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 1.74 ± eV
Point Group Symmetry C1
Synonyms
  • (23r,24s)-16beta,23:16alpha,24-diepoxy-9beta,19-cyclolanostane-3beta,15alpha,25-triol
InChIKey CNBHUROFMYCHGI-IEUUZZHOSA-N
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Elements H C O