(5α)-17-(Cyclopropylmethyl)-14-Hydroxy-6-Oxo-4,5-Epoxymorphinan-3-Yl Beta-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C26H31NO10 |
| IUPAC Name | (2s,3s,4s,5s,6s)-6-[[(4r,4as,7ar,12bs)-3-(cyclopropylmethyl)-4a-hydroxy-7-oxo-2,4,5,6,7a,13-hexahydro-1h-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 517.525 g·mol−1 |
| Heat of Formation | -1529.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.67 ± 1.08 D |
| Volume | 569.59 Å 3 |
| Surface Area | 449.55 Å 2 |
| HOMO Energy | -8.95 ± 0.55 eV |
| LUMO Energy | -0.18 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KCSKQJYZSCIQRR-NHBVSRAQSA-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 |