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(3b,22R)-Cholest-5-ene-3,22,25-triol 3,22-triacetate

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(3b,22R)-Cholest-5-ene-3,22,25-triol 3,22-triacetate
SpectraBase Compound ID 3bcNxGvq9P
InChI InChI=1S/C31H50O5/c1-19(28(36-21(3)33)14-15-29(4,5)34)25-10-11-26-24-9-8-22-18-23(35-20(2)32)12-16-30(22,6)27(24)13-17-31(25,26)7/h8,19,23-28,34H,9-18H2,1-7H3
InChIKey NHIYCAXBNGJZCH-UHFFFAOYSA-N
Mol Weight 502.7 g/mol
Molecular Formula C31H50O5
Exact Mass 502.365825 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JTuA3487aKR
Name (3b,22S)-Cholest-5-ene-3,22,25-triol 3,22-triacetate
CAS Registry Number 79435-62-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H50O5
InChI InChI=1S/C31H50O5/c1-19(28(36-21(3)33)14-15-29(4,5)34)25-10-11-26-24-9-8-22-18-23(35-20(2)32)12-16-30(22,6)27(24)13-17-31(25,26)7/h8,19,23-28,34H,9-18H2,1-7H3
InChIKey NHIYCAXBNGJZCH-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference E. Nakamura, I. Kuwajima, J. Am. Chem. Soc. 107, 2138 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3