(3α,11α)-3,11-Dihydroxylup-20(29)-En-28-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C30H48O4 |
| IUPAC Name | (1r,3as,5ar,5br,7ar,9r,11as,11br,12r,13ar,13br)-9,12-dihydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid |
| Molecular Mass | 472.700 g·mol−1 |
| Heat of Formation | -1036.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.71 ± 1.08 D |
| Volume | 595.24 Å 3 |
| Surface Area | 423.19 Å 2 |
| HOMO Energy | -9.69 ± 0.55 eV |
| LUMO Energy | 0.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CQYNGKPLHGNVHC-LEBDGTJJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |