(2R)-2-[(2R,3R,3Ar,6S,7S,9Br)-6-(2-Carboxyethyl)-2-Hydroxy-7-Isopropenyl-3A,6,9B-Trimethyl-2,3,3A,4,6,7,8,9B-Octahydro-1H-Cyclopenta[A]Naphthalen-3-Yl]-6-Methoxy-6-Methyl-5-Methyleneheptanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C32H48O6 |
| IUPAC Name | (2r)-2-[(2r,3r,3ar,6s,7s,9br)-6-(2-carboxyethyl)-2-hydroxy-7-isopropenyl-3a,6,9b-trimethyl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-3-yl]-6-methoxy-6-methyl-5-methylene-heptanoic acid |
| Molecular Mass | 528.720 g·mol−1 |
| Heat of Formation | -1242.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.98 ± 1.08 D |
| Volume | 686.23 Å 3 |
| Surface Area | 510.72 Å 2 |
| HOMO Energy | -8.91 ± 0.55 eV |
| LUMO Energy | 3.23 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VZIHBVSTTFISKH-CPCIMIGGSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |