(2R,4'S,5S,6S,8'R,10'E,13'S,14'E,16'E,20'R,21'R,24'S)-6-[(2E)-2-Buten-2-Yl]-21',24'-Dihydroxy-5,11',13',22'-Tetramethyl-2'-Oxo-3,4,5,6-Tetrahydrospiro[Pyran-2,6'-[3,7,19]Trioxatetracyclo[15.6.1.1~4,8~.0~20,24~]Pentacosa[10,14,16,22]Tetraen]-12'-Yl 2-Methylpropanoate
Properties
Property | Value |
---|---|
Formula | C38H54O9 |
IUPAC Name | (1'r,2r,4's,5s,8'r,10'e,12'r,13's,14'e,16'e,20'r,21'r,24's)-6-[(2z)-2-buten-2-yl]-21',24'-dihydroxy-5,11',13',22'-tetramethyl-2'-oxo-3,4,5,6-tetrahydrospiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.1 4,8 .0 20,24 ]pentacosa[10,14,16,22]tetraen]-12'-yl 2-methylpropanoate |
Molecular Mass | 654.830 g·mol−1 |
Heat of Formation | -1652.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.15 ± 1.08 D |
Volume | 822.93 Å 3 |
Surface Area | 580.46 Å 2 |
HOMO Energy | -9.36 ± 0.55 eV |
LUMO Energy | 2.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | XQJPRIJOJVJRFC-IGTGYTCBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |