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9-ALPHA-HYDROXY-SECO-RATIFEROLIDE-5-ALPHA-O-(2-METHYLBUTYRATE)
SpectraBase Compound ID CayqLM09SHK
InChI InChI=1S/C20H28O7/c1-6-8-15(22)20(25)12(5)14(21)9-13-11(4)19(24)26-16(13)17(20)27-18(23)10(3)7-2/h6,8,10,12-14,16-17,21,25H,4,7,9H2,1-3,5H3/b8-6+/t10?,12-,13?,14+,16+,17-,20+/m1/s1
InChIKey WFHINDLSACGWNX-TVCSKECKSA-N
Mol Weight 380.44 g/mol
Molecular Formula C20H28O7
Exact Mass 380.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETwyVsvUEm6
Name 9-ALPHA-HYDROXY-SECO-RATIFEROLIDE-5-ALPHA-O-(2-METHYLBUTYRATE)
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O7
InChI InChI=1S/C20H28O7/c1-6-8-15(22)20(25)12(5)14(21)9-13-11(4)19(24)26-16(13)17(20)27-18(23)10(3)7-2/h6,8,10,12-14,16-17,21,25H,4,7,9H2,1-3,5H3/b8-6+/t10?,12-,13?,14+,16+,17-,20+/m1/s1
InChIKey WFHINDLSACGWNX-TVCSKECKSA-N
Literature Reference Author B.CUI,Y.H.LEE,H.CHAI,J.C.TUCKER,C.R.FAIRCHILD,C.RAVENTOS-SUA REZ,B.LONG,K.E.LANE,
Literature Reference Citation J.NAT.PROD.,62,1545(1999)
Literature Reference DOI 10.1021/np990260y
Molecular Weight 380.438 g/mol
Solvent CDCl3
Source File Reference WANG1745