(8Xi,13Xi,14Xi,17Xi,22S,23R,24R)-22,23,24,25-Tetrahydroxy-9,10,14-Trimethyl-4,9-Cyclo-9,10-Secocholest-5-En-1-Yl β-D-Allopyranoside
Properties
Property | Value |
---|---|
Formula | C36H62O10 |
IUPAC Name | (3r,4r,5s,6s)-2-methyl-6-[(3s,8s,9s,10r,13r,14s,17r)-4,4,9,13,14-pentamethyl-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2,3,7,8,10,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-17-yl]heptane-2,3,4,5-tetrol |
Molecular Mass | 654.871 g·mol−1 |
Heat of Formation | 3757.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.96 ± 1.08 D |
Volume | 692.79 Å 3 |
Surface Area | 609.03 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | -2.77 ± eV |
Point Group Symmetry | C1 |
InChIKey | BQQVUJRUVFZIJJ-YIOJMVLRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O |