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3-BETA-(2-FUROYLOXY)-PREGNA-4,16-DIENE-6,20-DIONE
SpectraBase Compound ID BQ8HQMZD63l
InChI InChI=1S/C26H30O5/c1-15(27)18-6-7-19-17-14-22(28)21-13-16(31-24(29)23-5-4-12-30-23)8-10-26(21,3)20(17)9-11-25(18,19)2/h4-6,12-13,16-17,19-20H,7-11,14H2,1-3H3/t16-,17-,19-,20-,25+,26+/m0/s1
InChIKey AFSMNXNUJCEASM-PBBKICGNSA-N
Mol Weight 422.52 g/mol
Molecular Formula C26H30O5
Exact Mass 422.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GTiwjSKhP1q
Name 3-BETA-(2-FUROYLOXY)-PREGNA-4,16-DIENE-6,20-DIONE
Compound Number 10J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30O5
InChI InChI=1S/C26H30O5/c1-15(27)18-6-7-19-17-14-22(28)21-13-16(31-24(29)23-5-4-12-30-23)8-10-26(21,3)20(17)9-11-25(18,19)2/h4-6,12-13,16-17,19-20H,7-11,14H2,1-3H3/t16-,17-,19-,20-,25+,26+/m0/s1
InChIKey AFSMNXNUJCEASM-PBBKICGNSA-N
Literature Reference Author J.LI,H.LI,Y.LI
Literature Reference Citation CHEM.CENTR.J.,4,18,1(2010)
Molecular Weight 422.521 g/mol
Solvent CDCl3
Source File Reference UWIR11805