(1R,2S,3S,4S,5S,6S,8R,13S,16R,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
Properties
| Property | Value |
|---|---|
| Formula | C27H41NO8 |
| IUPAC Name | (1r,2s,3s,4s,5s,6s,8r,13s,16r,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 | -1394.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.19 ± 1.08 D |
| Volume | 588.86 Å 3 |
| Surface Area | 421.88 Å 2 |
| HOMO Energy | -8.34 ± 0.55 eV |
| LUMO Energy | 4.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DTTPWCNKTMQMTE-TYNNPWLESA-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 |