N-{[(5S,6S)-1,5,6,7,9,11,14-Heptahydroxy-3-Methyl-8,13-Dioxo-5,6,8,13-Tetrahydrobenzo[A]Tetracen-2-Yl]Carbonyl}Alanine
Properties
| Property | Value |
|---|---|
| Formula | C27H21NO12 |
| IUPAC Name | (2s)-2-[[(5s,6s)-1,5,6,7,9,11,14-heptahydroxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoic acid |
| Molecular Mass | 551.455 g·mol−1 |
| Heat of Formation | -1879.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.30 ± 1.08 D |
| Volume | 574.73 Å 3 |
| Surface Area | 472.48 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -1.71 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZYIREGFVRPWOMN-OWKMXCQISA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |