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3-BETA,19-DIHYDROXY-CHOLEST-5-EN-3-ACETATE
SpectraBase Compound ID Ho109zczVyO
InChI InChI=1S/C29H48O3/c1-19(2)7-6-8-20(3)25-11-12-26-24-10-9-22-17-23(32-21(4)31)13-16-29(22,18-30)27(24)14-15-28(25,26)5/h9,19-20,23-27,30H,6-8,10-18H2,1-5H3/t20-,23+,24+,25-,26+,27+,28-,29-/m1/s1
InChIKey ZUYKAEVLUWUNMD-KVHJHAPGSA-N
Mol Weight 444.7 g/mol
Molecular Formula C29H48O3
Exact Mass 444.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8LbaXovQ2Ct
Name CHOLEST-5-EN-3-BETA,19-DIOL-3-ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H48O3
InChI InChI=1S/C29H48O3/c1-19(2)7-6-8-20(3)25-11-12-26-24-10-9-22-17-23(32-21(4)31)13-16-29(22,18-30)27(24)14-15-28(25,26)5/h9,19-20,23-27,30H,6-8,10-18H2,1-5H3/t20-,23+,24+,25-,26+,27+,28-,29-/m1/s1
InChIKey ZUYKAEVLUWUNMD-KVHJHAPGSA-N
Literature Reference Author K.N.SCOTT,T.H.MARECI
Literature Reference Citation CAN.J.CHEM.,57,27(1979)
Literature Reference DOI 10.1139/v79-005
Molecular Weight 444.698 g/mol
Solvent CDCl3
Source File Reference UWED968