(5R,8S)-8-(3-Carbamimidamidophenyl)-6-Hydroxy-5-Isopropyl-3-Oxo-1-Phenyl-2,7-Dioxa-4-Aza-6-Phosphanonan-9-Oic Acid 6-Oxide

Molecule SVG Image

Properties Simple | Detailed

Formula C21H27N4O7P
IUPAC Name (2s)-2-[[(1r)-1-(benzyloxycarbonylamino)-2-methyl-propyl]-hydroxy-phosphoryl]oxy-2-(3-guanidinophenyl)acetic acid
Molecular Mass 478.435 g·mol−1
Heat of Formation -1282.5 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 551.39 Å 3
Surface Area 469.81 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
InChIKey MGJJGNQEZQSCJT-ZWKOTPCHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N