(1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30R,32S,35R)-1,18-Dihydroxy-12-{(2R)-1-[(1S,3R,4R)-4-Hydroxy-3-Methoxycyclohexyl]-2-Propanyl}-19-Methoxy-15,17,21,23,29,35-Hexamethyl-30-(5-Methyl-2-Thienyl)-11,36-Dioxa-4-Azatricyclo[30.3.1.0~4,9~]Hexatriaconta-16,24,26,28-Tetraene-2,3,10,14,20-Pentone
Properties
| Property | Value |
|---|---|
| Formula | C55H81NO12S |
| IUPAC Name | (1r,9s,12s,15r,16e,18r,19r,21r,23s,24e,26e,28e,30r,32s,35r)-1,18-dihydroxy-12-{(2r)-1-[(1s,3r,4r)-4-hydroxy-3-methoxycyclohexyl]-2-propanyl}-19-methoxy-15,17,21,23,29,35-hexamethyl-30-(5-methyl-2-thienyl)-11,36-dioxa-4-azatricyclo[30.3.1.0 4,9 ]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone |
| Molecular Mass | 980.296 g·mol−1 |
| Heat of Formation | -2313.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.60 ± 1.08 D |
| Volume | 1235.9 Å 3 |
| Surface Area | 760.49 Å 2 |
| HOMO Energy | -8.25 ± 0.55 eV |
| LUMO Energy | -0.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SDSGJAIFUCCAOV-MSLSVLDMSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |