(2R,3R,4S,5R,6E)-N-{[(3S)-1-(Cyclopropylcarbonyl)-3-Piperidinyl]Methyl}-3,4,5-Trihydroxy-2-Methoxy-8,8-Dimethyl-6-Nonenamide
Properties
Property | Value |
---|---|
Formula | C22H38N2O6 |
IUPAC Name | (e,2r,3r,4s,5r)-n-[[(3s)-1-(cyclopropanecarbonyl)-3-piperidyl]methyl]-3,4,5-trihydroxy-2-methoxy-8,8-dimethyl-non-6-enamide |
Molecular Mass | 426.547 g·mol−1 |
Heat of Formation | -1152.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.55 ± 1.08 D |
Volume | 544.37 Å 3 |
Surface Area | 464.44 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | 0.29 ± eV |
Point Group Symmetry | C1 |
InChIKey | JFNUXOSYQRHRBI-NNURDPEKSA-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 |