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METHYL-3-BETA-ACETOXY-5-BETA-CHOLAN-24-OATE

View entire compound with spectra: 1 NMR

METHYL-3-BETA-ACETOXY-5-BETA-CHOLAN-24-OATE
SpectraBase Compound ID 4ksui6KuP7J
InChI InChI=1S/C27H44O4/c1-17(6-11-25(29)30-5)22-9-10-23-21-8-7-19-16-20(31-18(2)28)12-14-26(19,3)24(21)13-15-27(22,23)4/h17,19-24H,6-16H2,1-5H3/t17?,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1
InChIKey DVIUCIPCTDVQAP-JBMFTQEKSA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H44O4
Exact Mass 432.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5pSj0Pkzk2
Name METHYL-3-BETA-ACETOXY-5-BETA-CHOLAN-24-OATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-17(6-11-25(29)30-5)22-9-10-23-21-8-7-19-16-20(31-18(2)28)12-14-26(19,3)24(21)13-15-27(22,23)4/h17,19-24H,6-16H2,1-5H3/t17?,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1
InChIKey DVIUCIPCTDVQAP-JBMFTQEKSA-N
Literature Reference Author A.M.SELDES,M.E.DELUCA,E.G.GROS
Literature Reference Citation MAGN.RES.CHEM.,24,185(1986)
Literature Reference DOI 10.1002/mrc.1260240302
Molecular Weight 432.644 g/mol
Solvent CDCl3
Source File Reference UNIW18336