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3-BETA-ACETOXYClERODININ-C

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3-BETA-ACETOXYClERODININ-C
SpectraBase Compound ID 8mH1aDuQCt6
InChI InChI=1S/C28H42O10/c1-7-32-24-12-19-11-22(37-25(19)38-24)26(6)15(2)10-23(36-18(5)31)27(13-33-16(3)29)20(26)8-9-21(35-17(4)30)28(27)14-34-28/h15,19-25H,7-14H2,1-6H3/t15-,19+,20-,21+,22-,23+,24-,25-,26+,27+,28-/m0/s1
InChIKey KELWGSSLXXIRKR-MTMQEDJLSA-N
Mol Weight 538.6 g/mol
Molecular Formula C28H42O10
Exact Mass 538.277798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ER0m6Psx3Wn
Name 3-BETA-ACETOXYClERODININ-C
Compound Number 4'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42O10
InChI InChI=1S/C28H42O10/c1-7-32-24-12-19-11-22(37-25(19)38-24)26(6)15(2)10-23(36-18(5)31)27(13-33-16(3)29)20(26)8-9-21(35-17(4)30)28(27)14-34-28/h15,19-25H,7-14H2,1-6H3/t15-,19+,20-,21+,22-,23+,24-,25-,26+,27+,28-/m0/s1
InChIKey KELWGSSLXXIRKR-MTMQEDJLSA-N
Literature Reference Author P.S.BEAUCHAMP,A.T.BOTTINI,M.C.CASELLES,V.DEV,H.HOPE,M.LARTER ,G.LEE,C.S.MATHELA,A
Literature Reference Citation PHYTOCHEM.,43,827(1996)
Literature Reference DOI 10.1016/0031-9422(96)00207-5
Molecular Weight 538.635 g/mol
Solvent CDCl3
Source File Reference UWMS2199