(1R,9S,12S,13R,14S,17R,18Z,21S,23S,24R,25S,27R)-17-Ethyl-12-[(1E)-1-{(1R,3R,4R)-4-[(1-Ethyl-1H-Indol-5-Yl)Oxy]-3-Methoxycyclohexyl}-1-Propen-2-Yl]-1,14-Dihydroxy-23,25-Dimethoxy-13,19,21,27-Tetramethyl-11,28-Dioxa-4-Azatricyclo[22.3.1.0~4,9~]Octacos-18-Ene-2,3,10,16-Tetrone
Properties
| Property | Value |
|---|---|
| Formula | C53H78N2O12 |
| IUPAC Name | (18e)-17-ethyl-12-[(e)-2-[4-(1-ethylindol-5-yl)oxy-3-methoxy-cyclohexyl]-1-methyl-vinyl]-1,14-dihydroxy-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone |
| Molecular Mass | 935.193 g·mol−1 |
| Heat of Formation | -2177.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.41 ± 1.08 D |
| Volume | 1178.38 Å 3 |
| Surface Area | 831.42 Å 2 |
| HOMO Energy | -8.01 ± 0.55 eV |
| LUMO Energy | -0.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CXVGRMOIFTUTMT-IUQQQLKSSA-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 |