9,19-Dihydroxy-13-Methoxy-11,17-Dimethyl-3,7,15,21-Tetraoxo-6,22-Dioxaheptacyclo[12.9.1.1~1,16~.1~4,8~.0~2,13~.0~12,26~.0~20,25~]Hexacosa-4,8(26),9,11,16(25),17,19-Heptaen-24-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C29H22O11 |
IUPAC Name | (1s,2r,24r)-9,19-dihydroxy-13-methoxy-11,17-dimethyl-3,7,15,21-tetraoxo-6,22-dioxaheptacyclo[12.9.1.1 1,16 .1 4,8 .0 2,13 .0 12,26 .0 20,25 ]hexacosa-4,8(26),9,11,16(25),17,19-heptaen-24-yl acetate |
Molecular Mass | 546.478 g·mol−1 |
Heat of Formation | -1692.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.43 ± 1.08 D |
Volume | 566.41 Å 3 |
Surface Area | 423.16 Å 2 |
HOMO Energy | -9.62 ± 0.55 eV |
LUMO Energy | 1.62 ± eV |
Point Group Symmetry | C1 |
InChIKey | WBQDAYWQELBEPU-UWFIUXRYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |