5-{[(5Xi,17Xi,20Xi)-24,25-Dihydroxy-3-Oxolanost-8-En-2-Yl]Oxy}-3-Hydroxy-3-Methyl-5-Oxopentanoic Acid
Properties
Property | Value |
---|---|
Formula | C36H58O8 |
IUPAC Name | 5-[[(10s,13r,14r)-17-(4,5-dihydroxy-1,5-dimethyl-hexyl)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-2-yl]oxy]-3-hydroxy-3-methyl-5-oxo-pentanoic acid |
Molecular Mass | 618.841 g·mol−1 |
Heat of Formation | 3585.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.18 ± 1.08 D |
Volume | 635.59 Å 3 |
Surface Area | 540.66 Å 2 |
HOMO Energy | -8.78 ± 0.55 eV |
LUMO Energy | -2.65 ± eV |
Point Group Symmetry | C1 |
InChIKey | FNHDSKHVYPYDAZ-VZPCPVQSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O |