(3β,6β)-3-Acetoxy-6,19-Dihydroxyurs-12-En-28-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C32H50O6 |
| IUPAC Name | (1r,2r,4as,6as,6br,8r,10s,12ar)-10-acetoxy-1,8-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Molecular Mass | 530.736 g·mol−1 |
| Heat of Formation | 3181.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.31 ± 1.08 D |
| Volume | 464.83 Å 3 |
| Surface Area | 381.03 Å 2 |
| HOMO Energy | -8.90 ± 0.55 eV |
| LUMO Energy | -2.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KBYMABZAFBTCMQ-ZTLMYXHKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |