1-O-[(2α,3Beta,5Xi,9Xi,18Xi,19α)-2,3,19,24-Tetrahydroxy-28-Oxoolean-12-En-28-Yl]-Beta-D-Glucopyranose
Properties
| Property | Value |
|---|---|
| Formula | C36H58O11 |
| IUPAC Name | [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1s,4ar,6as,6br,9s,10r,11r,12ar)-1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate |
| Molecular Mass | 666.839 g·mol−1 |
| Heat of Formation | 3593.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.06 ± 1.08 D |
| Volume | 711.4 Å 3 |
| Surface Area | 583.51 Å 2 |
| HOMO Energy | -6.62 ± 0.55 eV |
| LUMO Energy | -2.25 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CMZFNIMQBCBHEX-WYZQMZRLSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |