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CYCLOARTANE-3-BETA,24,25-TRIOL-3-ACETATE;ISOMER-#1
SpectraBase Compound ID KNXJ3Am727K
InChI InChI=1S/C32H54O4/c1-20(9-12-25(34)28(5,6)35)22-13-15-30(8)24-11-10-23-27(3,4)26(36-21(2)33)14-16-31(23)19-32(24,31)18-17-29(22,30)7/h20,22-26,34-35H,9-19H2,1-8H3/t20?,22-,23+,24+,25?,26+,29-,30+,31-,32+/m1/s1
InChIKey CHYZWIVQCJNRIW-NQSDTZGESA-N
Mol Weight 502.8 g/mol
Molecular Formula C32H54O4
Exact Mass 502.40221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4DFLR5Xvjf
Name CYCLOARTANE-3-BETA,24,25-TRIOL-3-ACETATE;ISOMER-#2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H54O4
InChI InChI=1S/C32H54O4/c1-20(9-12-25(34)28(5,6)35)22-13-15-30(8)24-11-10-23-27(3,4)26(36-21(2)33)14-16-31(23)19-32(24,31)18-17-29(22,30)7/h20,22-26,34-35H,9-19H2,1-8H3/t20?,22-,23+,24+,25?,26+,29-,30+,31-,32+/m1/s1
InChIKey CHYZWIVQCJNRIW-NQSDTZGESA-N
Literature Reference Author J.DEPASCUALTERESA,J.G.URONES,I.S.MARCOS,P.BASABE,M.J.S.CUADR ADO,R.F.MORO
Literature Reference Citation PHYTOCHEM.,26,1767(1987)
Literature Reference DOI 10.1016/S0031-9422(00)82286-4
Molecular Weight 502.778 g/mol
Solvent CDCl3
Source File Reference UWCS7876