N~2~-{(2R,4S,5S)-6-Cyclohexyl-4-Hydroxy-2-Isobutyl-5-[(N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Phenylalanyl-L-Histidyl)Amino]Hexanoyl}-L-Lysyl-L-Phenylalanine
Properties
| Property | Value |
|---|---|
| Formula | C51H76N8O9 |
| IUPAC Name | (2s)-2-[[(2s)-6-amino-2-[[(2r,4s,5s)-5-[[(2s)-2-[[(2s)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-3-(1h-imidazol-3-ium-5-id-5-yl)propanoyl]amino]-6-cyclohexyl-4-hydroxy-2-isobutyl-hexanoyl]amino]hexanoyl]amino]-3-phenyl-propanoic acid |
| Molecular Mass | 945.197 g·mol−1 |
| Heat of Formation | -1876.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.55 ± 1.08 D |
| Volume | 1214.08 Å 3 |
| Surface Area | 853.98 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | 0.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YHLJEWZZOJLRNJ-XDDFAUCWSA-P |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |