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methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate

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methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate
SpectraBase Compound ID E4oMR4XKuE4
InChI InChI=1S/C23H38O5/c1-15(25)28-19-16-7-8-18-22(3,10-6-11-23(18,4)20(26)27-5)17(16)9-12-21(19,2)13-14-24/h16-19,24H,6-14H2,1-5H3/t16-,17+,18-,19+,21-,22-,23-/m1/s1
InChIKey NQWIPNPNACHLKF-CDJHUENSSA-N
Mol Weight 394.6 g/mol
Molecular Formula C23H38O5
Exact Mass 394.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OohHXt0t2P
Name methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H38O5
InChI InChI=1S/C23H38O5/c1-15(25)28-19-16-7-8-18-22(3,10-6-11-23(18,4)20(26)27-5)17(16)9-12-21(19,2)13-14-24/h16-19,24H,6-14H2,1-5H3/t16-,17+,18-,19+,21-,22-,23-/m1/s1
InChIKey NQWIPNPNACHLKF-CDJHUENSSA-N
Literature Reference Author A.SANFELICIANO,M.MEDARDE,F.TOME,B.HEBRERO,E.CABALLERO
Literature Reference Citation MAGN.RES.CHEM.,27,1166(1989)
Literature Reference DOI 10.1002/mrc.1260271211
Molecular Weight 394.552 g/mol
Solvent CDCl3
Source File Reference UWCS16168