(1S,3S,7R,8R,8As)-8-{2-[(2R,4S)-4-Hydroxy-1-{[5-(Hydroxymethyl)-6-Methoxy-2-Naphthyl]Methyl}-6-Oxo-2-Piperidinyl]Ethyl}-3,7-Dimethyl-1,2,3,7,8,8A-Hexahydro-1-Naphthalenyl (2R)-2-Methylbutanoate
Properties
Property | Value |
---|---|
Formula | C37H49NO6 |
IUPAC Name | [(1s,3s,7r,8r,8as)-8-[2-[(2r,4s)-4-hydroxy-1-[[5-(hydroxymethyl)-6-methoxy-2-naphthyl]methyl]-6-oxo-2-piperidyl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2r)-2-methylbutanoate |
Molecular Mass | 603.788 g·mol−1 |
Heat of Formation | -1135.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.66 ± 1.08 D |
Volume | 764.56 Å 3 |
Surface Area | 526.04 Å 2 |
HOMO Energy | -8.63 ± 0.55 eV |
LUMO Energy | -0.65 ± eV |
Point Group Symmetry | C1 |
InChIKey | WPVRNXUYVXQXPY-UVJQNAMXSA-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 |