(6β,8Xi,9Xi,12Alpha,13Alpha,14β,20R)-3,6,12-Trihydroxy-4,4,14,17-Tetramethyl-18-Norcholest-24-En-20-Yl β-D-Allopyranoside
Properties
Property | Value |
---|---|
Formula | C36H62O9 |
IUPAC Name | (2s,3r,4r,5s,6r)-2-[(1r)-1,5-di(methyl)-1-[(3r,4s,5r,6r,8r,9r,10r,12s,13r,14r,17s)-4,4,10,14,17-pentamethyl-3,6,12-trioxido-2,3,5,6,7,8,9,11,12,13,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-17-yl]hex-4-enoxy]-6-(oxidomethyl)tetrahydropyran-2,3,4,5,6-pentaide-3,4,5-triolate |
Molecular Mass | 638.872 g·mol−1 |
Heat of Formation | -2000.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.06 ± 1.08 D |
Volume | 791.37 Å 3 |
Surface Area | 551.9 Å 2 |
HOMO Energy | -9.30 ± 0.55 eV |
LUMO Energy | 0.89 ± eV |
Point Group Symmetry | C1 |
InChIKey | QLPKLNOLHUEWSE-JZWNZNJWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |