19-Hydroxy-3-[(3-Methylbutanoyl)Oxy]Urs-12-En-28-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C35H56O5 |
| IUPAC Name | (1r,2r,4as,6ar,6as,6br,8ar,10s,12ar,14br)-1,2,6a,6b,9,9,12a-heptamethyl-10-(3-methylbutanoyloxy)-1-oxido-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-2h-picene-4a-carboxylate |
| Molecular Mass | 556.816 g·mol−1 |
| Heat of Formation | -1315.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.71 ± 1.08 D |
| Volume | 703.58 Å 3 |
| Surface Area | 504.8 Å 2 |
| HOMO Energy | -8.79 ± 0.55 eV |
| LUMO Energy | 0.86 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VNSKBPUANWSMPF-HSCDEYQLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |