Methyl (2Z)-4-{[(5β,6β)-17-(Cyclopropylmethyl)-3,14-Dihydroxy-4,5-Epoxymorphinan-6-Yl]Amino}-4-Oxo-2-Butenoate
Properties
| Property | Value |
|---|---|
| Formula | C25H30N2O6 |
| IUPAC Name | methyl (e)-4-[[(3r,4s,4ar,7s,7as,12br)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl]amino]-4-oxo-but-2-enoate |
| Molecular Mass | 454.516 g·mol−1 |
| Heat of Formation | -801.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.71 ± 1.08 D |
| Volume | 521.98 Å 3 |
| Surface Area | 431.85 Å 2 |
| HOMO Energy | -8.53 ± 0.55 eV |
| LUMO Energy | -1.02 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PQKHESYTSKMWFP-LAZMBETPSA-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 |