(16α,17Beta)-3,16-Dihydroxyestra-1(10),2,4-Trien-17-Yl Beta-D-Glucopyranosiduronic Acid
Properties
Property | Value |
---|---|
Formula | C24H32O9 |
IUPAC Name | (2r,3r,4r,5r,6s)-6-[[(8s,9r,13r,14r,16s,17s)-3,16-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
Molecular Mass | 464.505 g·mol−1 |
Heat of Formation | 1518.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.03 ± 1.08 D |
Volume | 451.67 Å 3 |
Surface Area | 398.74 Å 2 |
HOMO Energy | -9.36 ± 0.55 eV |
LUMO Energy | -2.92 ± eV |
Point Group Symmetry | C1 |
InChIKey | CZGFLAQOJPXVRV-DDTNRNEOSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O |