(6R,8S,9R,12R,16S,17S)-6,9,12-Trihydroxy-16-Methyl-8-(2-Methyl-2-Propanyl)-2,4,14,19-Tetraoxahexacyclo[8.7.2.0~1,11~.0~3,7~.0~7,11~.0~13,17~]Nonadecane-5,15,18-Trione

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Formula C20H24O10
IUPAC Name (1s,3r,6r,7s,9r,10s,11r,12r,13r,16s)-6,9,12-trihydroxy-16-methyl-8-(2-methyl-2-propanyl)-2,4,14,19-tetraoxahexacyclo[8.7.2.0 1,11 .0 3,7 .0 7,11 .0 13,17 ]nonadecane-5,15,18-trione
Molecular Mass 424.399 g·mol−1
Heat of Formation -1750.9 ± 16.7 kJ·mol−1
Dipole Moment 3.31 ± 1.08 D
Volume 444.54 Å 3
Surface Area 330.62 Å 2
HOMO Energy -10.66 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
InChIKey KDKROYXEHCYLJQ-CFTIQBHYSA-N
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