(2α,3Beta)-2-Acetoxy-3-Hydroxyurs-12-En-28-Oic Acid
Properties
Property | Value |
---|---|
Formula | C32H50O5 |
IUPAC Name | (1s,2r,4as,6ar,6as,6br,8ar,10r,11r,12ar,14br)-11-acetoxy-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1h-picene-4a-carboxylic acid |
Molecular Mass | 514.736 g·mol−1 |
Heat of Formation | -1210.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.64 ± 1.08 D |
Volume | 645.28 Å 3 |
Surface Area | 467.18 Å 2 |
HOMO Energy | -8.94 ± 0.55 eV |
LUMO Energy | 1.09 ± eV |
Point Group Symmetry | C1 |
InChIKey | GJRGKZWNIQVOIY-MSPBTUIHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |