{(2S,3R,5S,6S)-6-[(2S,3S,4S,6R)-6-{(2S,2'R,3'R,4S,5'S)-5'-Ethyl-2'-Hydroxy-5'-[(1S)-1-Hydroxyethyl]-2,3',4-Trimethyloctahydro-2,2'-Bifuran-5-Yl}-3-Hydroxy-4-Methyl-5-Oxo-2-Octanyl]-3,5-Dimethyltetrahydro-2H-Pyran-2-Yl}Ethaneperoxoic Acid

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Formula C33H58O10
IUPAC Name 2-[(2s,3r,5s,6s)-6-[(1s,2s,3s,5r)-5-[(2s,3s,5s)-5-[(2r,3r,5s)-5-ethyl-2-hydroxy-5-[(1s)-1-hydroxyethyl]-3-methyl-tetrahydrofuran-2-yl]-3,5-dimethyl-tetrahydrofuran-2-yl]-2-hydroxy-1,3-dimethyl-4-oxo-heptyl]-3,5-dimethyl-tetrahydropyran-2-yl]peroxyacetic acid
Molecular Mass 614.808 g·mol−1
Heat of Formation -2111.0 ± 16.7 kJ·mol−1
Dipole Moment 3.33 ± 1.08 D
Volume 782.47 Å 3
Surface Area 508.63 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy 3.72 ± eV
Point Group Symmetry C1
InChIKey TUKSVVJYALUTJH-UIXVFWCJSA-N
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Elements H C O