2,5-Dioxo-1-{[6-({5-[(4R)-2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl]Pentanoyl}Amino)Hexanoyl]Oxy}-3-Pyrrolidinesulfonic Acid
Properties
| Property | Value |
|---|---|
| Formula | C20H30N4O9S2 |
| IUPAC Name | (3s)-1-[6-[5-[(3as,4r,6as)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanoyloxy]-2,5-dioxo-pyrrolidine-3-sulfonic acid |
| Molecular Mass | 534.604 g·mol−1 |
| Heat of Formation | -1489.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.06 ± 1.08 D |
| Volume | 617.1 Å 3 |
| Surface Area | 439.46 Å 2 |
| HOMO Energy | -8.52 ± 0.55 eV |
| LUMO Energy | -0.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UQZHJQWIISKTJN-ZXTQRBJTSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |