(2R,3R,4R,5S,6R)-3-Acetamido-5-Hydroxy-4-{[(3R)-3-Hydroxydodecanoyl]Amino}-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl [(2R,3S,4R,5R)-5-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl Dihydrogen Diphosphate
Properties
Property | Value |
---|---|
Formula | C29H50N4O18P2 |
IUPAC Name | [(2r,3r,4r,5s,6r)-3-acetamido-5-hydroxy-4-[[(3r)-3-hydroxydodecanoyl]amino]-6-(hydroxymethyl)tetrahydropyran-2-yl] [[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate |
Molecular Mass | 804.671 g·mol−1 |
Heat of Formation | -4085.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.15 ± 1.08 D |
Volume | 908.37 Å 3 |
Surface Area | 745.1 Å 2 |
HOMO Energy | -9.60 ± 0.55 eV |
LUMO Energy | -1.59 ± eV |
Point Group Symmetry | C1 |
InChIKey | AGYVEKOUTSGPCD-SSVOXRMNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |