John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HsTQyPk98VS SpectraBase Spectrum ID=2BrYuhKSZEx

(accessed ).
SOLACONGESTIDINE=(25R)-22,26-EPIMINO-5-ALPHA-CHOLEST-22(N)-EN-3-BETA-OL
SpectraBase Compound ID HsTQyPk98VS
InChI InChI=1S/C27H45NO/c1-17-5-10-25(28-16-17)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h17-24,29H,5-16H2,1-4H3/t17-,18-,19-,20-,21-,22+,23-,24-,26-,27+/m0/s1
InChIKey MSKAAWFUKWQOQS-ZDUNFQFUSA-N
Mol Weight 399.7 g/mol
Molecular Formula C27H45NO
Exact Mass 399.350115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2BrYuhKSZEx
Name SOLACONGESTIDINE=(25R)-22,26-EPIMINO-5-ALPHA-CHOLEST-22(N)-EN-3-BETA-OL
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45NO
InChI InChI=1S/C27H45NO/c1-17-5-10-25(28-16-17)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h17-24,29H,5-16H2,1-4H3/t17-,18-,19-,20-,21-,22+,23-,24-,26-,27+/m0/s1
InChIKey MSKAAWFUKWQOQS-ZDUNFQFUSA-N
Literature Reference Author G.J.BIRD,D.J.COLLINS,F.W.EASTWOOD,R.H.EXNER
Literature Reference Citation AUSTR.J.CHEM.,32,797(1979)
Literature Reference DOI 10.1071/ch9790797
Molecular Weight 399.660 g/mol
Solvent CDCl3
Source File Reference UNIW17256
SpectraBase Batch ID 2Ggo9CZthVa