N-[4-(3-Amino-1-Oxo-1,5,6,6A,7,8,10,10A-Octahydropyrimido[4,5-C][2,6]Naphthyridin-9(2H)-Yl)Benzoyl]Glutamic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C22H26N6O6
IUPAC Name (2s)-2-[[4-[(6as,10ar)-3-amino-1-oxo-4,5,6,6a,7,8,10,10a-octahydropyrimido[4,5-h][2,6]naphthyridin-9-yl]benzoyl]amino]pentanedioic acid
Molecular Mass 470.478 g·mol−1
Heat of Formation -881.4 ± 16.7 kJ·mol−1
Dipole Moment 12.63 ± 1.08 D
Volume 528.73 Å 3
Surface Area 457.87 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey MUNDNNLSVBKBJD-YUELXQCFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N