N-[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]-[[(2R,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy]Phosphonamidic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C19H24N7O8P
IUPAC Name n-[(2s)-2-amino-3-(4-hydroxyphenyl)propanoyl]-[[(2r,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]phosphonamidic acid
Molecular Mass 509.410 g·mol−1
Heat of Formation -1375.4 ± 16.7 kJ·mol−1
Dipole Moment 0.46 ± 1.08 D
Volume 551.96 Å 3
Surface Area 461.33 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
InChIKey SGUPAZCHFRBUNL-QTOWJTHWSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N