Methyl 5-[(3As,5R,6R,6As)-5-Hydroxy-6-[(1E,3S,5S)-3-Hydroxy-5-Methyl-1-Nonen-1-Yl](5-~3~H)-1,3A,4,5,6,6A-Hexahydro-2-Pentalenyl]Pentanoate
Properties
| Property | Value |
|---|---|
| Formula | C24H40O4 |
| IUPAC Name | methyl 5-[(3as,5r,6r,6as)-5-hydroxy-6-[(e,3s,5r)-3-hydroxy-5-methyl-non-1-enyl]-1,3a,4,5,6,6a-hexahydropentalen-2-yl]pentanoate |
| Molecular Mass | 392.572 g·mol−1 |
| Heat of Formation | -947.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.76 ± 1.08 D |
| Volume | 538.72 Å 3 |
| Surface Area | 394.17 Å 2 |
| HOMO Energy | -9.18 ± 0.55 eV |
| LUMO Energy | 1.10 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NTQOAURYZKLASL-IKAVVODPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |