(2α,3Beta,5Beta,14Xi,22R)-2,3,14,20,25-Pentahydroxy-6-Oxocholest-7-En-22-Yl α-D-Galactopyranoside
Properties
Property | Value |
---|---|
Formula | C33H54O12 |
IUPAC Name | (2s,3s,5r,9r,10r,13r,14s,17r)-17-[(1r,2r)-1,5-dihydroxy-1,5-dimethyl-2-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hexyl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-6-one |
Molecular Mass | 642.775 g·mol−1 |
Heat of Formation | -2449.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.23 ± 1.08 D |
Volume | 759.29 Å 3 |
Surface Area | 539.24 Å 2 |
HOMO Energy | -9.86 ± 0.55 eV |
LUMO Energy | -0.27 ± eV |
Point Group Symmetry | C1 |
InChIKey | OYLAWXRQIJWVHG-NVFSSHFGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |