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IMPURITY-4;17-ALPHA-ACETOXYL-6-BETA-HYDROXYL-6-ALPHA-METHYLPREGNA-4-ENE-3,20-DIONE
SpectraBase Compound ID ICAa2Mj0Fbg
InChI InChI=1S/C24H34O5/c1-14(25)24(29-15(2)26)11-8-19-17-13-23(5,28)20-12-16(27)6-9-21(20,3)18(17)7-10-22(19,24)4/h12,17-19,28H,6-11,13H2,1-5H3/t17-,18+,19+,21-,22+,23-,24+/m1/s1
InChIKey BIIFPBLHBAQCTJ-MCLNPTNPSA-N
Mol Weight 402.5 g/mol
Molecular Formula C24H34O5
Exact Mass 402.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 105E5AKyZcR
Name M-2;6-BETA-HYDROXY-MPA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H34O5
InChI InChI=1S/C24H34O5/c1-14(25)24(29-15(2)26)11-8-19-17-13-23(5,28)20-12-16(27)6-9-21(20,3)18(17)7-10-22(19,24)4/h12,17-19,28H,6-11,13H2,1-5H3/t17-,18+,19+,21-,22+,23-,24+/m1/s1
InChIKey BIIFPBLHBAQCTJ-MCLNPTNPSA-N
Literature Reference Author J.CHEN,J.W.ZHANG,L.YANG,W.LI
Literature Reference Citation CHEM.PHARM.BULL.,57,835(2009)
Literature Reference DOI 10.1248/cpb.57.835
Molecular Weight 402.531 g/mol
Sample ID 2843
Solvent CDCl3