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(25S)-Cholest-5-ene-3b,16b,26-triol

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(25S)-Cholest-5-ene-3b,16b,26-triol
SpectraBase Compound ID 1fjOeX9YyLm
InChI InChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)25-24(30)15-23-21-9-8-19-14-20(29)10-12-26(19,3)22(21)11-13-27(23,25)4/h8,17-18,20-25,28-30H,5-7,9-16H2,1-4H3
InChIKey NUHIVWGZNPMOCV-UHFFFAOYSA-N
Mol Weight 418.7 g/mol
Molecular Formula C27H46O3
Exact Mass 418.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vliuLFrbsu
Name (25S)-Cholest-5-ene-3b,16b,26-triol
CAS Registry Number 53755-50-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O3
InChI InChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)25-24(30)15-23-21-9-8-19-14-20(29)10-12-26(19,3)22(21)11-13-27(23,25)4/h8,17-18,20-25,28-30H,5-7,9-16H2,1-4H3
InChIKey NUHIVWGZNPMOCV-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference A. Uomori, S. Seo, T. Sato, J. Chem. Soc. Perkin I 1713 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3