(2E)-N-[(2S,3R,4R,5R,6R)-2-{[(3S,4S,5R,6S)-3-Acetamido-4,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}-6-{(2S)-2-[(2R,3S,4R,5R)-5-(2,4-Dioxotetrahydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]-2-Hydroxyethyl}-4,5-Dihydroxytetrahydro-2H-Pyran-3-Yl]-5-Methyl-2-Hexenamide
Properties
Property | Value |
---|---|
Formula | C30H48N4O16 |
IUPAC Name | (e)-n-[(2s,3r,4r,5r,6r)-2-[(2s,3s,4s,5r,6s)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-[(2s)-2-[(2r,3s,4r,5r)-5-(2,4-dioxohexahydropyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-2-hydroxy-ethyl]-4,5-dihydroxy-tetrahydropyran-3-yl]-5-methyl-hex-2-enamide |
Molecular Mass | 720.719 g·mol−1 |
Heat of Formation | -3064.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.64 ± 1.08 D |
Volume | 837.62 Å 3 |
Surface Area | 596.61 Å 2 |
HOMO Energy | -9.67 ± 0.55 eV |
LUMO Energy | 0.03 ± eV |
Point Group Symmetry | C1 |
InChIKey | VFVPUOZOQGGMBI-UPTNORBVSA-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 |