(3β,9Xi,15Alpha,16Alpha,18Xi,21β,22Alpha)-22-Acetoxy-3,15,16,21-Tetrahydroxyolean-12-En-28-Yl 2-Methylbutanoate
Properties
| Property | Value |
|---|---|
| Formula | C37H60O8 |
| IUPAC Name | [(3r,4r,4ar,5s,6r,6ar,6as,6br,8ar,10s,12ar,14bs)-4-acetoxy-3,5,6,10-tetrahydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl]methyl (2r)-2-methylbutanoate |
| Molecular Mass | 632.867 g·mol−1 |
| Heat of Formation | -1861.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.10 ± 1.08 D |
| Volume | 781.41 Å 3 |
| Surface Area | 529.36 Å 2 |
| HOMO Energy | -9.36 ± 0.55 eV |
| LUMO Energy | 0.58 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JPXCXKPLNCDTCM-FZLILWDNSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |