Methyl (3β,22Alpha)-3,22-Dihydroxyolean-12-En-29-Oate
Properties
| Property | Value |
|---|---|
| Formula | C31H50O4 |
| IUPAC Name | methyl (2s,4s,4ar,6ar,6as,6br,8ar,10s,12ar,14bs)-4,10-dihydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylate |
| Molecular Mass | 486.726 g·mol−1 |
| Heat of Formation | 4197.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.88 ± 1.08 D |
| Volume | 537.35 Å 3 |
| Surface Area | 431.77 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | 0.12 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DNAMZLPKKDEZFD-IIFYCFSCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |