[(2R,3R,4S,5R,6R)-3,4-Dihydroxy-5-[(E)-[(2S,3R,4R,5S)-3-Hydroxy-2-Methyl-5-(Phosphonooxymethyl)-4-Piperidyl]Methyleneamino]-6-Methyl-Tetrahydropyran-2-Yl] [Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-[(5R)-5-Methyl-2,4-Dioxo-Hexahydropyrimidin-1-Yl]Tetrahydrofuran-2-Yl]Methoxy]Phosphoryl] Hydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C24H43N4O19P3
IUPAC Name [(2r,3r,4s,5r,6r)-3,4-dihydroxy-5-[(e)-[(2s,3r,4r,5s)-3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-piperidyl]methyleneamino]-6-methyl-tetrahydropyran-2-yl] [hydroxy-[[(2r,3s,5r)-3-hydroxy-5-[(5r)-5-methyl-2,4-dioxo-hexahydropyrimidin-1-yl]tetrahydrofuran-2-yl]methoxy]phosphoryl] hydrogen phosphate
Molecular Mass 784.535 g·mol−1
Heat of Formation -4394.7 ± 16.7 kJ·mol−1
Dipole Moment 8.12 ± 1.08 D
Volume 835.93 Å 3
Surface Area 656.18 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
InChIKey PWIZFDCNVYXDLP-KTUZIDOASA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N