(5Xi,16α,18α,21Beta,22α)-16,21,22,28-Tetrahydroxyolean-12-En-3-One
Properties
| Property | Value |
|---|---|
| Formula | C30H48O5 |
| IUPAC Name | (4as,6ar,6bs,8r,8ar,9r,10r,12ar,14ar,14br)-8,9,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1h-picen-3-one |
| Molecular Mass | 488.699 g·mol−1 |
| Heat of Formation | 4258.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 11.45 ± 1.08 D |
| Volume | 541.0 Å 3 |
| Surface Area | 429.92 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | -2.51 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GXFKYAQDKJGESG-PHOCLCFFSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |