(3β)-Cholest-5-En-3-Yl β-D-Glucopyranoside

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Formula C33H56O6
IUPAC Name (2s,3r,4s,5s,6r)-2-[[(3s,8r,9r,10r,13r,14r,17s)-17-[(1r)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 548.794 g·mol−1
Heat of Formation -1434.6 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 709.88 Å 3
Surface Area 543.99 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy 4.22 ± eV
Point Group Symmetry C1
InChIKey FSMCJUNYLQOAIM-ZMMPPKDRSA-N
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