(1S,9S,11S,12Z,14Z,19Z,22R)-9,11-Dihydroxy-22-Methyl-6,23-Dioxa-26-Thia-2,17,27-Triazatricyclo[17.5.2.1~4,7~]Heptacosa-4,7(27),12,14,19-Pentaene-3,18,24-Trione
Properties
| Property | Value |
|---|---|
| Formula | C22H27N3O7S |
| IUPAC Name | (1s,9s,11s,12z,14z,19z,22r)-9,11-dihydroxy-22-methyl-6,23-dioxa-26-thia-2,17,27-triazatricyclo[17.5.2.1 4,7 ]heptacosa-4,7(27),12,14,19-pentaene-3,18,24-trione |
| Molecular Mass | 477.531 g·mol−1 |
| Heat of Formation | -1006.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.77 ± 1.08 D |
| Volume | 552.38 Å 3 |
| Surface Area | 424.22 Å 2 |
| HOMO Energy | -8.82 ± 0.55 eV |
| LUMO Energy | -0.67 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UXWOXTQWVMFRSE-CPEQWFEASA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |