(2β,3β,5β,22R)-2,3,14,22-Tetrahydroxy-6-Oxocholest-7-En-25-Yl D-Glucopyranoside
Properties
Property | Value |
---|---|
Formula | C33H54O11 |
IUPAC Name | (2s,3r,5r,9r,10r,13r,14s,17r)-2,3,14-trihydroxy-17-[(1s,2r)-2-hydroxy-1,5-dimethyl-5-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hexyl]-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-6-one |
Molecular Mass | 626.775 g·mol−1 |
Heat of Formation | -2247.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.75 ± 1.08 D |
Volume | 757.3 Å 3 |
Surface Area | 575.67 Å 2 |
HOMO Energy | -9.96 ± 0.55 eV |
LUMO Energy | -0.70 ± eV |
Point Group Symmetry | C1 |
InChIKey | YJBCWBWOULRKGL-QMDKUVAFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |