(3S,3Ar,4S,6S,6Ar,7S,8S,9As,9Bs)-6-Acetoxy-3,3A-Dihydroxy-4-[(4-{4-Hydroxy-3-[6-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Hexyl]Phenyl}Butanoyl)Oxy]-3,6,9-Trimethyl-8-{[(2Z)-2-Methyl-2-Butenoyl]Oxy}-2-Oxododecahydroazuleno[4,5-B]Furan-7-Yl Octanoate
Properties
| Property | Value |
|---|---|
| Formula | C51H77NO15 |
| IUPAC Name | [(3s,3ar,4s,6s,6ar,7s,8s,9r,9as,9bs)-6-acetoxy-4-[4-[3-[6-(tert-butoxycarbonylamino)hexyl]-4-hydroxy-phenyl]butanoyloxy]-3,3a-dihydroxy-3,6,9-trimethyl-8-[(z)-2-methylbut-2-enoyl]oxy-2-oxo-4,5,6a,7,8,9,9a,9b-octahydroazuleno[4,5-b]furan-7-yl] octanoate |
| Molecular Mass | 944.155 g·mol−1 |
| Heat of Formation | -3163.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.68 ± 1.08 D |
| Volume | 1178.62 Å 3 |
| Surface Area | 934.14 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | 0.05 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MJLFQZMEQWPDGU-SWOPQUFRSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |