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(22S,23S,24R)-24-METHYL-22,23-EPOXY-3-ALPHA,5-CYCLO-5-ALPHA-CHOLESTAN-6-BETA-YL-ACETATE
SpectraBase Compound ID 42jflyb9Q1v
InChI InChI=1S/C30H48O3/c1-16(2)17(3)26-27(33-26)18(4)22-8-9-23-21-14-25(32-19(5)31)30-15-20(30)10-13-29(30,7)24(21)11-12-28(22,23)6/h16-18,20-27H,8-15H2,1-7H3/t17-,18+,20+,21+,22-,23+,24+,25-,26+,27-,28-,29-,30-/m1/s1
InChIKey MCTKESWBFMPTEG-OGDAQVGGSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4xy2y9VmZCG
Name (22S,23S,24R)-24-METHYL-22,23-EPOXY-3-ALPHA,5-CYCLO-5-ALPHA-CHOLESTAN-6-BETA-YL-ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-16(2)17(3)26-27(33-26)18(4)22-8-9-23-21-14-25(32-19(5)31)30-15-20(30)10-13-29(30,7)24(21)11-12-28(22,23)6/h16-18,20-27H,8-15H2,1-7H3/t17-,18+,20+,21+,22-,23+,24+,25-,26+,27-,28-,29-,30-/m1/s1
InChIKey MCTKESWBFMPTEG-OGDAQVGGSA-N
Literature Reference Author R.RICCIO,M.IORIZZI,O.S.GRECO,L.MINALE,M.DEBRAY,J.L.MENOU
Literature Reference Citation J.NAT.PROD.,48,756(1985)
Literature Reference DOI 10.1021/np50041a007
Molecular Weight 456.709 g/mol
Solvent CDCl3
Source File Reference UWCS3542