(9Xi,11α,14Xi)-3,20-Dioxopregn-4-En-11-Yl 4-{[2-(1H-Imidazol-4-Yl)Ethyl]Amino}-4-Oxobutanoate
Properties
Property | Value |
---|---|
Formula | C30H41N3O5 |
IUPAC Name | [(8s,9s,10r,11r,13s,14r,17s)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-11-yl] 4-[2-(1h-imidazol-3-ium-5-id-5-yl)ethylamino]-4-oxo-butanoate |
Molecular Mass | 523.664 g·mol−1 |
Heat of Formation | -929.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 11.24 ± 1.08 D |
Volume | 650.07 Å 3 |
Surface Area | 506.07 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | -0.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | VNERKJGHSVUODX-VYYGMJHTSA-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 |