(2E,4E,6E)-7-[6'-Acetoxy-8'-Hydroxy-5-(Hydroxymethyl)-4A',7'-Dimethyl-2,4,4'-Trioxo-1',4,4',4A',4B',5,5',6',7',8',8A',10A'-Dodecahydro-2'H-Spiro[Furan-3,3'-Phenanthren]-2'-Yl]-2,4,6-Heptatrienoic Acid
Properties
Property | Value |
---|---|
Formula | C29H34O10 |
IUPAC Name | (2e,4e,6e)-7-[(2s,3r,4as,4bs,5's,6r,7r,8s,8ar,10ar)-6-acetoxy-8-hydroxy-5'-(hydroxymethyl)-4a,7-dimethyl-2',4,4'-trioxo-spiro[2,4b,5,6,7,8,8a,10a-octahydro-1h-phenanthrene-3,3'-tetrahydrofuran]-2-yl]hepta-2,4,6-trienoic acid |
Molecular Mass | 542.574 g·mol−1 |
Heat of Formation | -1644.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.61 ± 1.08 D |
Volume | 628.55 Å 3 |
Surface Area | 513.74 Å 2 |
HOMO Energy | -9.65 ± 0.55 eV |
LUMO Energy | 1.64 ± eV |
Point Group Symmetry | C1 |
InChIKey | UNCBZODCSVGKDO-TYOXOPNTSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |