(2β,3β,5Xi,18Alpha)-3-(β-D-Glucopyranosyloxy)-2,23-Dihydroxyolean-12-Ene-28,29-Dioic Acid
Properties
| Property | Value |
|---|---|
| Formula | C36H56O12 |
| IUPAC Name | (2r,4ar,6ar,6as,6br,8as,9r,10r,11s,12ar,14br)-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-10-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2,4a-dicarboxylic acid |
| Molecular Mass | 680.823 g·mol−1 |
| Heat of Formation | -2482.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.04 ± 1.08 D |
| Volume | 794.64 Å 3 |
| Surface Area | 564.2 Å 2 |
| HOMO Energy | -9.17 ± 0.55 eV |
| LUMO Energy | 0.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HYBMIQRHHBBMMB-ONAPIPECSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |