(1Ar,1Bs,4Ar,7As,7Bs,8R,9R,9As)-4A,7B-Dihydroxy-3-(Hydroxymethyl)-1,1,6,8-Tetramethyl-9-{[(2Z)-2-Methyl-2-Butenoyl]Oxy}-5-Oxo-1,1A,1B,4,4A,5,7A,7B,8,9-Decahydro-9Ah-Cyclopropa[3,4]Benzo[1,2-E]Azulen-9A-Yl Decanoate
Properties
Property | Value |
---|---|
Formula | C35H52O8 |
IUPAC Name | (1ar,1bs,4ar,7as,7bs,8r,9r,9as)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-9-{[(2z)-2-methyl-2-butenoyl]oxy}-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9ah-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl decanoate |
Molecular Mass | 600.783 g·mol−1 |
Heat of Formation | -1549.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.26 ± 1.08 D |
Volume | 761.79 Å 3 |
Surface Area | 604.13 Å 2 |
HOMO Energy | -9.37 ± 0.55 eV |
LUMO Energy | 2.78 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | QWYNFKKVBDGBLL-MCQGUPFJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |