(3S)-3-[(1R)-2-{[(4S)-6-Ethyl-3,4-Dihydrospiro[Chromene-2,1'-Cyclobutan]-4-Yl]Amino}-1-Hydroxyethyl]-4-Azabicyclo[10.3.1]Hexadeca-1(16),12,14-Trien-5-One
Properties
| Property | Value |
|---|---|
| Formula | C31H42N2O3 |
| IUPAC Name | (10s)-10-[(1r)-2-[[(4s)-6-ethylspiro[chromane-2,1'-cyclobutane]-4-yl]amino]-1-hydroxy-ethyl]-9-azabicyclo[10.3.1]hexadeca-1(15),12(16),13-trien-8-one |
| Molecular Mass | 490.677 g·mol−1 |
| Heat of Formation | -558.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.95 ± 1.08 D |
| Volume | 626.11 Å 3 |
| Surface Area | 453.51 Å 2 |
| HOMO Energy | -8.65 ± 0.55 eV |
| LUMO Energy | 3.18 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NUISAGYICVEVAE-HZFUHODCSA-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 |