(9E,11S,12R,13R,14R,15R,16R,17S,18S,19E,21Z)-2,11,15,17,27,29-Hexahydroxy-3,7,12,14,16,18,22-Heptamethyl-6,23-Dioxo-8,30-Dioxa-24-Azatetracyclo[23.3.1.1~4,7~.0~5,28~]Triaconta-1(28),2,4,9,19,21,25(29),26-Octaen-13-Yl Acetate
Properties
| Property | Value |
|---|---|
| Formula | C36H45NO12 |
| IUPAC Name | (9e,11s,12s,13r,14s,15r,16r,17s,18s)-2,11,15,17,27,29-hexahydroxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1 4,7 .0 5,28 ]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl acetate |
| Molecular Mass | 683.742 g·mol−1 |
| Heat of Formation | -2090.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.46 ± 1.08 D |
| Volume | 804.3 Å 3 |
| Surface Area | 541.52 Å 2 |
| HOMO Energy | -8.29 ± 0.55 eV |
| LUMO Energy | -1.29 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OBIXNJCNRZELPA-PBGGDXIJSA-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 |