4-Amino-2,3-Dihydroxy-N-[1-(8-Hydroxy-1-Oxo-3,4-Dihydro-1H-Isochromen-3-Yl)-3-Methylbutyl]-5-Methylhexanamide
Properties
Property | Value |
---|---|
Formula | C21H32N2O6 |
IUPAC Name | (2s,3s,4r)-4-amino-2,3-dihydroxy-n-[(1s)-1-[(3r)-8-hydroxy-1-oxo-isochroman-3-yl]-3-methyl-butyl]-5-methyl-hexanamide |
Molecular Mass | 408.489 g·mol−1 |
Heat of Formation | -1211.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.55 ± 1.08 D |
Volume | 501.01 Å 3 |
Surface Area | 381.78 Å 2 |
HOMO Energy | -9.10 ± 0.55 eV |
LUMO Energy | -0.98 ± eV |
Point Group Symmetry | C1 |
InChIKey | FFHBLZAZBVDUEH-GSIXPNJASA-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 |