2-Amino-1,3-Propanediyl Bis[(3-{2-[2-(3-{[2-({3-[4-(3-{[3-(β-D-Glucopyranosyloxy)-5-Nitrobenzoyl]Amino}Propyl)-1-Piperazinyl]Propyl}Amino)-3,4-Dioxo-1-Cyclobuten-1-Yl]Amino}Propoxy)Ethoxy]Ethoxy}Propyl)Carbamate]
Properties
| Property | Value |
|---|---|
| Formula | C79H123N15O32 |
| IUPAC Name | [2-amino-3-[3-[2-[2-[3-[[2-[3-[4-[3-[[3-nitro-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzoyl]amino]propyl]piperazin-1-yl]propylamino]-3,4-dioxo-cyclobuten-1-yl]amino]propoxy]ethoxy]ethoxy]propylcarbamoyloxy]propyl] n-[3-[2-[2-[3-[[2-[3-[4-[3-[[3-nitro-5-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzoyl]amino]propyl]piperazin-1-yl]propylamino]-3,4-dioxo-cyclobuten-1-yl]amino]propoxy]ethoxy]ethoxy]propyl]carbamate |
| Molecular Mass | 1794.903 g·mol−1 |
| Heat of Formation | -4432.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 18.14 ± 1.08 D |
| Volume | 2108.61 Å 3 |
| Surface Area | 1511.07 Å 2 |
| HOMO Energy | -7.71 ± 0.55 eV |
| LUMO Energy | -1.27 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BPHYTQORKHDHAH-PITJZOSMSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |