6-[(3β,8Xi,9Xi,14Xi)-Cholest-5-En-3-Yloxy]Hexyl 1-Thio-Alpha-D-Mannopyranoside

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Formula C39H68O6S
IUPAC Name (2r,3r,4s,5s,6s)-2-[6-[[(10r,13r,17r)-17-(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]hexylsulfanyl]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 665.019 g·mol−1
Heat of Formation 4667.5 ± 16.7 kJ·mol−1
Dipole Moment 13.06 ± 1.08 D
Volume 651.9 Å 3
Surface Area 540.37 Å 2
HOMO Energy -7.86 ± 0.55 eV
LUMO Energy -3.56 ± eV
Point Group Symmetry C1
InChIKey CGPHGTBLEBJCCB-DYTFNWJNSA-N
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