(2S)-2-{[(2S)-2-{[(2R)-2-{[3-Acetamido-2,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-4-Yl]Oxy}Propanoyl]Amino}Propanoyl]Amino}Pentanedioic Acid
Properties
Property | Value |
---|---|
Formula | C19H31N3O12 |
IUPAC Name | (2r)-2-[[(2s)-2-[[(2r)-2-[(2s,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-4-yl]oxypropanoyl]amino]propanoyl]amino]pentanedioic acid |
Molecular Mass | 493.462 g·mol−1 |
Heat of Formation | -2374.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.80 ± 1.08 D |
Volume | 583.66 Å 3 |
Surface Area | 447.92 Å 2 |
HOMO Energy | -9.28 ± 0.55 eV |
LUMO Energy | 0.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | ONWXTUROIDEFMO-PUFOHHGRSA-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 |