(2Z)-4-[(1S,2S,19S,21R)-14-Hydroxy-11-Isopropenyl-8,23,23-Trimethyl-5-(3-Methyl-2-Buten-1-Yl)-16,20-Dioxo-3,7,22-Trioxaheptacyclo[17.4.1.1~8,12~.0~2,17~.0~2,21~.0~4,15~.0~6,13~]Pentacosa-4(15),5,13,17-Tetraen-21-Yl]-2-Methyl-2-Butenoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C38H44O8 |
| IUPAC Name | (2z)-4-[(1s,2s,19s,21r)-14-hydroxy-11-isopropenyl-8,23,23-trimethyl-5-(3-methyl-2-buten-1-yl)-16,20-dioxo-3,7,22-trioxaheptacyclo[17.4.1.1 8,12 .0 2,17 .0 2,21 .0 4,15 .0 6,13 ]pentacosa-4(15),5,13,17-tetraen-21-yl]-2-methyl-2-butenoic acid |
| Molecular Mass | 628.751 g·mol−1 |
| Heat of Formation | -1374.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.22 ± 1.08 D |
| Volume | 739.11 Å 3 |
| Surface Area | 489.62 Å 2 |
| HOMO Energy | -8.69 ± 0.55 eV |
| LUMO Energy | 2.20 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NVYMXCXFPJLTOZ-PDNJWIIHSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |