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(25R)-5-BETA-SPIROSTAN-3-BETA-OL,(SMILAGENIN)
SpectraBase Compound ID DlHHhwtoxVT
InChI InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17+,18-,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
InChIKey GMBQZIIUCVWOCD-UQHLGXRBSA-N
Mol Weight 416.6 g/mol
Molecular Formula C27H44O3
Exact Mass 416.329045 g/mol
Enantiomer InChIKey GMBQZIIUCVWOCD-WHTWLSOHSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent PYRIDINE-D5
  • SMILAGENIN=(25R)-5-BETA-SPIROSTAN-3-BETA-OL
Title Journal or Book Year
Carbon-13 nmr spectra of 5β-steroidal sapogenins. Reassignment of the F-ring carbon signals of (25)-spirostans Tetrahedron Letters 1981
13C n.m.r. spectra of steroids —a survey and commentary Organic Magnetic Resonance 1977

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