(1S,4As,12As)-3-Acetyl-9-{[2,6-Dideoxy-3-O-(2,6-Dideoxy-β-D-Arabino-Hexopyranosyl)-β-D-Arabino-Hexopyranosyl]Oxy}-2,6,7-Trihydroxy-1-Methoxy-8-Methyl-4,5-Dioxo-1,5,12,12A-Tetrahydro-4A(4H)-Tetracenyl 2,6-Dideoxy-3-C-Methyl-β-D-Ribo-Hexopyranosyl-(1->3)-2,6-Dideoxy-β-D-Lyxo-Hexopyranosyl-(1->3)-2,6-Dideoxy-β-D-Arabino-Hexopyranoside
Properties
Property | Value |
---|---|
Formula | C53H72O24 |
IUPAC Name | 2-acetyl-12a-[4-[4-(4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-8-[4-(4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3,10,11-trihydroxy-4-methoxy-9-methyl-4a,5-dihydro-4h-tetracene-1,12-dione |
Molecular Mass | 1093.124 g·mol−1 |
Heat of Formation | -4407.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.44 ± 1.08 D |
Volume | 1224.0 Å 3 |
Surface Area | 937.85 Å 2 |
HOMO Energy | -8.51 ± 0.55 eV |
LUMO Energy | -0.80 ± eV |
Point Group Symmetry | C1 |
InChIKey | HCTADUCAPFYREF-OFWAWROCSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |