N-[(1S,2R,3R,4S,5S,6R)-4-Amino-3-({(2R,3R,6S)-3-Amino-6-[(1S)-1-Aminoethyl]Tetrahydro-2H-Pyran-2-Yl}Oxy)-2,5-Dihydroxy-6-Methoxycyclohexyl]-N~2~-Carbamoyl-N-Methylglycinamide
Properties
Property | Value |
---|---|
Formula | C18H36N6O7 |
IUPAC Name | n-[(1s,2r,3r,4s,5s,6r)-4-amino-3-[(2r,3r,6s)-3-amino-6-[(1s)-1-aminoethyl]tetrahydropyran-2-yl]oxy-2,5-dihydroxy-6-methoxy-cyclohexyl]-n-methyl-2-ureido-acetamide |
Molecular Mass | 448.514 g·mol−1 |
Heat of Formation | -1383.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.01 ± 1.08 D |
Volume | 535.3 Å 3 |
Surface Area | 414.89 Å 2 |
HOMO Energy | -9.15 ± 0.55 eV |
LUMO Energy | 0.75 ± eV |
Point Group Symmetry | C1 |
InChIKey | VKGIGFQBOYWLHV-APGVDKLISA-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 |