(1R,2S)-1-[[[(4R,4Ar,5Ar,6S,12As)-4-(Dimethylamino)-1,6,10,11,12A-Pentahydroxy-6-Methyl-3,12-Dioxo-4,4A,5,5A-Tetrahydrotetracene-2-Carbonyl]Amino]Methyl]Pyrrolidine-2-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C28H33N3O10 |
| IUPAC Name | (1r,2s)-1-[[[(4r,4ar,5ar,6s,12as)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carbonyl]amino]methyl]pyrrolidine-2-carboxylic acid |
| Molecular Mass | 571.576 g·mol−1 |
| Heat of Formation | -1620.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.49 ± 1.08 D |
| Volume | 636.99 Å 3 |
| Surface Area | 464.59 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -0.77 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SPJRPARYTUBINA-CRRREAHRSA-N |
| QR Code | Generate QR Code |
| Links | PubChem |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |