(3S,6E,8S,9R,10E,12S,13S,16S,17R)-3-Benzyl-9-Hydroxy-6,8,10,12,14,16-Hexamethyl-17-[(2S,4S)-4-Methyl-2-Hexanyl]-2,5-Dioxo-1-Oxa-4-Azacycloheptadeca-6,10,14-Trien-13-Yl Acetate
Properties
Property | Value |
---|---|
Formula | C37H55NO6 |
IUPAC Name | [(3s,6e,8s,9r,10e,12s,13s,14z,16s,17r)-3-benzyl-17-[(1s,3s)-1,3-dimethylpentyl]-9-hydroxy-6,8,10,12,14,16-hexamethyl-2,5-dioxo-1-oxa-4-azacycloheptadeca-6,10,14-trien-13-yl] acetate |
Molecular Mass | 609.836 g·mol−1 |
Heat of Formation | -1290.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.01 ± 1.08 D |
Volume | 813.27 Å 3 |
Surface Area | 536.47 Å 2 |
HOMO Energy | -9.54 ± 0.55 eV |
LUMO Energy | 0.11 ± eV |
Point Group Symmetry | C1 |
InChIKey | WIRRTALUVUQONX-KHQLJQCKSA-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 |