(2S,3S)-3-{[N-(3,3-Dimethylbutanoyl)-3-Methyl-L-Valyl-N,N-Bis{1-[N-(3,3-Dimethylbutanoyl)-3-Methyl-L-Valyl-N-{(1S,2S)-1-Hydroxy-1-[N-(4-Iodobenzyl)Amide]-2-Propanyl}-L-α-Asparaginyl]-1H-Pyrrol-2-Yl}-L-Asparaginyl]Amino}-2-Hydroxy-N-(4-Iodobenzyl)Butanamide
Properties
| Property | Value |
|---|---|
| Formula | C31H44IN5O6 |
| IUPAC Name | (2s)-2-(3,3-dimethylbutanoylamino)-n-[(1s)-1-[[(1s,2s)-2-hydroxy-3-[(4-iodophenyl)methylamino]-1-methyl-3-oxo-propyl]carbamoyl]-3-oxo-3-pyrrol-1-yl-propyl]-3,3-dimethyl-butanamide |
| Molecular Mass | 709.615 g·mol−1 |
| Heat of Formation | -1143.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.47 ± 1.08 D |
| Volume | 784.72 Å 3 |
| Surface Area | 574.63 Å 2 |
| HOMO Energy | -8.82 ± 0.55 eV |
| LUMO Energy | 2.61 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DUBMDYQWHSIBPD-FBESYSLLSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | I H C O N |