5-[(1R,2R,5R,6R)-2,5-Dihydroxy-7-Oxabicyclo[4.1.0]Hept-2-Yl]-3-{[(1S,2S,4Ar,6S,8As)-2,6-Dimethyl-1,2,4A,5,6,7,8,8A-Octahydro-1-Naphthalenyl]Carbonyl}-4-Hydroxy-2(1H)-Pyridinone

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Formula C24H31NO6
IUPAC Name 3-[(1s,2s,4ar,6s,8as)-2,6-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-5-[(1r,2r,5r,6r)-2,5-dihydroxy-7-oxabicyclo[4.1.0]heptan-5-yl]-4-hydroxy-pyridin-2-one
Molecular Mass 429.506 g·mol−1
Heat of Formation -1032.2 ± 16.7 kJ·mol−1
Dipole Moment 2.59 ± 1.08 D
Volume 502.76 Å 3
Surface Area 408.36 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
InChIKey YQTIWISENUYMQD-UOIYJLCQSA-N
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