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3α,20β-dihydroxy-11-oxo-5β-pregnan-21-oic acid, methyl ester
SpectraBase Compound ID 9p75UxSrMZy
InChI InChI=1S/C22H34O5/c1-21-9-8-13(23)10-12(21)4-5-14-15-6-7-16(19(25)20(26)27-3)22(15,2)11-17(24)18(14)21/h12-16,18-19,23,25H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,18-,19+,21+,22+/m1/s1
InChIKey ZPFUUTIZGOTKAL-QJHGGAOBSA-N
Mol Weight 378.5 g/mol
Molecular Formula C22H34O5
Exact Mass 378.240624 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7EPZUfxEFRZ
Name 3α,20β-dihydroxy-11-oxo-5β-pregnan-21-oic acid, methyl ester
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O5
InChI InChI=1S/C22H34O5/c1-21-9-8-13(23)10-12(21)4-5-14-15-6-7-16(19(25)20(26)27-3)22(15,2)11-17(24)18(14)21/h12-16,18-19,23,25H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,18-,19+,21+,22+/m1/s1
InChIKey ZPFUUTIZGOTKAL-QJHGGAOBSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 39937M
Solvent CDCl3