4-Amino-1,2,4,6-Tetradeoxy-2-{[N-(Phenoxyacetyl)-L-Valyl]Amino}-1,6-Diphenyl-D-Glucitol
Properties
Property | Value |
---|---|
Formula | C31H39N3O5 |
IUPAC Name | (2s)-n-[(1s,2s,3r,4r)-3-amino-1-benzyl-2,4-dihydroxy-5-phenyl-pentyl]-3-methyl-2-[(2-phenoxyacetyl)amino]butanamide |
Molecular Mass | 533.658 g·mol−1 |
Heat of Formation | -776.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.32 ± 1.08 D |
Volume | 667.78 Å 3 |
Surface Area | 530.38 Å 2 |
HOMO Energy | -9.25 ± 0.55 eV |
LUMO Energy | -0.15 ± eV |
Point Group Symmetry | C1 |
InChIKey | ASWZRLFSSZUWDR-UZMSACSVSA-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 |