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#3;FE-PEO;(5R,6R,7R,9R,13S,14R,20R)-(5-ALPHA,7-ALPHA)-4,5-EPOXY-6-(2-FLUOROETHOXY)-3-HYDROXY-ALPHA,17-DIMETHYL-ALPHA-(2-PHENYLETHYL)-6,14-ETHENO-MORPHIN

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#3;FE-PEO;(5R,6R,7R,9R,13S,14R,20R)-(5-ALPHA,7-ALPHA)-4,5-EPOXY-6-(2-FLUOROETHOXY)-3-HYDROXY-ALPHA,17-DIMETHYL-ALPHA-(2-PHENYLETHYL)-6,14-ETHENO-MORPHIN
SpectraBase Compound ID FLnIi5ezwwL
InChI InChI=1S/C31H36FNO4/c1-28(35,11-10-20-6-4-3-5-7-20)23-19-29-12-13-31(23,36-17-15-32)27-30(29)14-16-33(2)24(29)18-21-8-9-22(34)26(37-27)25(21)30/h3-9,12-13,23-24,27,34-35H,10-11,14-19H2,1-2H3/t23-,24-,27-,28?,29-,30+,31+/m1/s1
InChIKey ROMGPBJZBHIHQL-FDGLFNRQSA-N
Mol Weight 505.6 g/mol
Molecular Formula C31H36FNO4
Exact Mass 505.262837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KlB4HVJZVE
Name #3;FE-PEO;(5R,6R,7R,9R,13S,14R,20R)-(5-ALPHA,7-ALPHA)-4,5-EPOXY-6-(2-FLUOROETHOXY)-3-HYDROXY-ALPHA,17-DIMETHYL-ALPHA-(2-PHENYLETHYL)-6,14-ETHENO-MORPHIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H36FNO4
InChI InChI=1S/C31H36FNO4/c1-28(35,11-10-20-6-4-3-5-7-20)23-19-29-12-13-31(23,36-17-15-32)27-30(29)14-16-33(2)24(29)18-21-8-9-22(34)26(37-27)25(21)30/h3-9,12-13,23-24,27,34-35H,10-11,14-19H2,1-2H3/t23-,24-,27-,28?,29-,30+,31+/m1/s1
InChIKey ROMGPBJZBHIHQL-FDGLFNRQSA-N
Literature Reference Author J.MARTON,G.HENRIKSEN
Literature Reference Citation MOLECULES,17,11554(2012)
Literature Reference DOI 10.3390/molecules171011554
Molecular Weight 505.630 g/mol
Sample ID 814
Solvent CDCl3