(1R,3R,4R,4As,8As)-4-Hydroxy-4-[2-(2-Hydroxy-5-Oxo-2,5-Dihydro-3-Furanyl)Ethyl]-3,4A,8,8-Tetramethyldecahydro-1-Naphthalenyl Acetate

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Properties Simple | Detailed

Formula C22H34O6
IUPAC Name [(1r,3r,4r,4as,8as)-4-hydroxy-4-[2-[(2s)-2-hydroxy-5-oxo-2h-furan-3-yl]ethyl]-3,4a,8,8-tetramethyl-decalin-1-yl] acetate
Molecular Mass 394.502 g·mol−1
Heat of Formation -1251.4 ± 16.7 kJ·mol−1
Dipole Moment 4.66 ± 1.08 D
Volume 488.06 Å 3
Surface Area 378.86 Å 2
HOMO Energy -10.05 ± 0.55 eV
LUMO Energy 2.36 ± eV
Point Group Symmetry C1
InChIKey ZHDFOHJIRGVVGC-IFQRYZMPSA-N
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