(1S,2R)-1-(3,4-Dimethoxyphenyl)-2-{4-[(2R,3S)-3-(Hydroxymethyl)-5-(3-Hydroxypropyl)-7-Methoxy-2,3-Dihydro-1-Benzofuran-2-Yl]-2,6-Dimethoxyphenoxy}-1,3-Propanediol

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Properties Simple | Detailed

Formula C32H40O11
IUPAC Name (1s,2r)-1-(3,4-dimethoxyphenyl)-2-[4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydrobenzofuran-2-yl]-2,6-dimethoxy-phenoxy]propane-1,3-diol
Molecular Mass 600.653 g·mol−1
Heat of Formation -1637.5 ± 16.7 kJ·mol−1
Dipole Moment 7.93 ± 1.08 D
Volume 716.79 Å 3
Surface Area 536.8 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
InChIKey ABIOAIYWIAGXDZ-JZQDODDWSA-N
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