(5α,6α)-17-(Cyclobutylmethyl)-6,14-Dihydroxy-4,5-Epoxymorphinan-3-Yl 2-Acetoxybenzoate
Properties
Property | Value |
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Formula | C30H33NO7 |
IUPAC Name | [(4r,4as,7s,7ar,12bs)-3-(cyclobutylmethyl)-4a,7-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] 2-acetoxybenzoate |
Molecular Mass | 519.586 g·mol−1 |
Heat of Formation | -1001.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.17 ± 1.08 D |
Volume | 595.24 Å 3 |
Surface Area | 472.32 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -0.85 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | MTRORSPXFPXAFS-YSAQZOOCSA-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 |