3-[(2-Hydroxy-3,3-Dimethyl-4-{[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}Butanoyl)Amino]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C15H27NO10 |
IUPAC Name | 3-[[(2r)-2-hydroxy-3,3-dimethyl-4-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-butanoyl]amino]propanoic acid |
Molecular Mass | 381.376 g·mol−1 |
Heat of Formation | -1986.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.57 ± 1.08 D |
Volume | 433.19 Å 3 |
Surface Area | 359.68 Å 2 |
HOMO Energy | -10.21 ± 0.55 eV |
LUMO Energy | 0.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | GMURXYJSTRMISD-BGWRNRDFSA-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 |