[(1S,4S,5S,6R,9S,10R,12R,14R)-4-(Benzoyloxy)-5,6-Dihydroxy-3,11,11,14-Tetramethyl-15-Oxotetracyclo[7.5.1.0~1,5~.0~10,12~]Pentadeca-2,7-Dien-7-Yl]Methyl Benzoate
Properties
Property | Value |
---|---|
Formula | C34H36O7 |
IUPAC Name | [(1s,4s,5s,6r,9s,10r,12r,14r)-4-(benzoyloxy)-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0 1,5 .0 10,12 ]pentadeca-2,7-dien-7-yl]methyl benzoate |
Molecular Mass | 556.645 g·mol−1 |
Heat of Formation | -865.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.54 ± 1.08 D |
Volume | 657.0 Å 3 |
Surface Area | 471.05 Å 2 |
HOMO Energy | -9.41 ± 0.55 eV |
LUMO Energy | 2.23 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | GIMKEHNOTHXONN-NXBFFCPZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |