(3β)-3-({[(1S,2R)-2-Carboxycyclohexyl]Carbonyl}Oxy)-11-Oxoolean-12-En-30-Oic Acid
Properties
| Property | Value |
|---|---|
| Formula | C38H24O7 |
| IUPAC Name | carbon dioxide; isobenzofuran-1,3-dione; (17r)-2',7,10,13,18-pentamethylenespiro[bicyclo[12.4.1]nonadeca-14(19),15-dien-3,5,8,11-tetrayne-17,1'-cyclopropane]-2-one; prop-1-yn-1-ol |
| Molecular Mass | 592.593 g·mol−1 |
| Heat of Formation | 4596.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.01 ± 1.08 D |
| Volume | 680.26 Å 3 |
| Surface Area | 519.55 Å 2 |
| HOMO Energy | -8.68 ± 0.55 eV |
| LUMO Energy | -2.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IPIHZIYZLLMCRF-APMXPKBPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |