(5α,6Beta,14Beta,18R)-18-[(2S)-2-Hydroxy-2-Pentanyl]-6-Methoxy-17-Methyl-7,8-Didehydro-18,19-Dihydro-4,5-Epoxy-6,14-Ethenomorphinan-3-Ol
Properties
Property | Value |
---|---|
Formula | C25H33NO4 |
IUPAC Name | (5alpha,6beta,14beta,18r)-18-[(2s)-2-hydroxy-2-pentanyl]-6-methoxy-17-methyl-7,8-didehydro-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol |
Molecular Mass | 411.534 g·mol−1 |
Heat of Formation | -579.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.19 ± 1.08 D |
Volume | 495.85 Å 3 |
Surface Area | 377.61 Å 2 |
HOMO Energy | -8.54 ± 0.55 eV |
LUMO Energy | 0.15 ± eV |
Point Group Symmetry | C1 |
CAS Number(s) |
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InChIKey | CAHCBJPUTCKATP-NNFUYEGGSA-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 |