(1S,2R)-2-{4-[(2S,3R,4R,5S)-5-(1,3-Benzodioxol-5-Yl)-3,4-Dimethyltetrahydro-2-Furanyl]-2-Methoxyphenoxy}-1-(3,4-Dimethoxyphenyl)-1-Propanol

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Properties Simple | Detailed

Formula C31H36O8
IUPAC Name (1s,2r)-2-[4-[(2s,3r,4r,5s)-5-(1,3-benzodioxol-5-yl)-3,4-dimethyl-tetrahydrofuran-2-yl]-2-methoxy-phenoxy]-1-(3,4-dimethoxyphenyl)propan-1-ol
Molecular Mass 536.613 g·mol−1
Heat of Formation -1064.6 ± 16.7 kJ·mol−1
Dipole Moment 2.69 ± 1.08 D
Volume 641.78 Å 3
Surface Area 511.13 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
InChIKey BYTPMMJRDFCGKX-GJRFZWDISA-N
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