(3α)-3-Hydroxyurs-12-En-23-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C30H48O3 |
| IUPAC Name | (3r,4s,4ar,6ar,6bs,8ar,11r,12s,12ar,14ar,14br)-3-hydroxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1h-picene-4-carboxylic acid |
| Molecular Mass | 456.700 g·mol−1 |
| Heat of Formation | -877.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.17 ± 1.08 D |
| Volume | 587.56 Å 3 |
| Surface Area | 422.04 Å 2 |
| HOMO Energy | -8.97 ± 0.55 eV |
| LUMO Energy | 1.35 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NBGQZFQREPIKMG-SKPJQDMCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |