(3β,5β)-3-Acetoxy-5,14,22-Trihydroxy-19-Oxocard-20-Enolide
Properties
Property | Value |
---|---|
Formula | C25H34O8 |
IUPAC Name | [(3s,5s,8r,9s,10s,13r,14s,17r)-10-formyl-5,14-dihydroxy-17-[(3r)-3-hydroxy-2-oxo-3h-furan-4-yl]-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] acetate |
Molecular Mass | 462.533 g·mol−1 |
Heat of Formation | 1231.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.56 ± 1.08 D |
Volume | 479.81 Å 3 |
Surface Area | 437.15 Å 2 |
HOMO Energy | -9.53 ± 0.55 eV |
LUMO Energy | -3.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | BDTCKWPJSFDTGT-PWJWUTLCSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O |