(5Xi,9Xi,12β,13Xi,14Xi,17Xi,20Xi)-12,20-Dihydroxydammar-24-En-3-Yl β-D-Allopyranoside
Properties
| Property | Value |
|---|---|
| Formula | C25H18O8 |
| IUPAC Name | (2r,3r,4s,5s,6r)-2-[[(3s,5r,8r,9r,10r,12r,13r,14r,17s)-12-hydroxy-17-[(1s)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
| Molecular Mass | 446.406 g·mol−1 |
| Heat of Formation | 3662.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 10.72 ± 1.08 D |
| Volume | 470.68 Å 3 |
| Surface Area | 415.88 Å 2 |
| HOMO Energy | -8.94 ± 0.55 eV |
| LUMO Energy | -3.03 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CKUVNOCSBYYHIS-AQTYKQEJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |