14-Ethyl-2-Hydroxy-4,6,19-Trimethoxy-16-Methyl-9,11-Dioxa-14-Azaheptacyclo[10.7.2.1~2,5~.0~1,13~.0~3,8~.0~8,12~.0~16,20~]Docos-21-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C27H41NO8 |
IUPAC Name | (1r,2s,3s,4s,5r,6s,8r,12s,16r,19s,20r,21s)-14-ethyl-2-hydroxy-4,6,19-trimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.1 2,5 .0 1,13 .0 3,8 .0 8,12 .0 16,20 ]docos-21-yl acetate |
Molecular Mass | 507.616 g·mol−1 |
Heat of Formation | -1368.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.03 ± 1.08 D |
Volume | 593.27 Å 3 |
Surface Area | 415.68 Å 2 |
HOMO Energy | -8.00 ± 0.55 eV |
LUMO Energy | 4.33 ± eV |
Point Group Symmetry | C1 |
InChIKey | DTTPWCNKTMQMTE-OUWSDNHWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |