(2S)-2-[[(1S)-5-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[6-[(3As,4S,6Ar)-2-Oxo-1,3,3A,4,6,6A-Hexahydrothieno[3,4-D]Imidazol-4-Yl]Hexanoylamino]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Ethoxy]Propanoyl-[(4-Bromophenyl)Methyl]Amino]-1-Carboxy-Pentyl]Carbamoylamino]Pentanedioic Acid
Properties
| Property | Value |
|---|---|
| Formula | C57H95BrN6O22S |
| IUPAC Name | (2s)-2-[[(1s)-5-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[6-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]hexanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoyl-[(4-bromophenyl)methyl]amino]-1-carboxy-pentyl]carbamoylamino]pentanedioic acid |
| Molecular Mass | 1328.360 g·mol−1 |
| Heat of Formation | -4005.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.50 ± 1.08 D |
| Volume | 1564.75 Å 3 |
| Surface Area | 1331.35 Å 2 |
| HOMO Energy | -8.84 ± 0.55 eV |
| LUMO Energy | -0.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BWJXSXULCISGDF-CRIRDAMVSA-N |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C H O N S Br |