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(1S,5S,6R,7S,9R,10S)-5-METHYLBUTANOYLOXY-1,4,9-TRIHYDROXY-2-OXO-XANTH-11-EN-6,12-OLIDE
SpectraBase Compound ID MsEql9UA4F
InChI InChI=1S/C20H30O8/c1-6-9(2)18(24)28-17-16-13(11(4)19(25)27-16)8-14(22)12(5)20(17,26)15(23)7-10(3)21/h9-10,12-14,16-17,21-22,26H,4,6-8H2,1-3,5H3/t9?,10?,12-,13?,14+,16+,17-,20+/m1/s1
InChIKey CFNPAWULBAZKEI-URALZRDDSA-N
Mol Weight 398.45 g/mol
Molecular Formula C20H30O8
Exact Mass 398.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J0cHCz3SC8n
Name (1S,5S,6R,7S,9R,10S)-5-METHYLBUTANOYLOXY-1,4,9-TRIHYDROXY-2-OXO-XANTH-11-EN-6,12-OLIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O8
InChI InChI=1S/C20H30O8/c1-6-9(2)18(24)28-17-16-13(11(4)19(25)27-16)8-14(22)12(5)20(17,26)15(23)7-10(3)21/h9-10,12-14,16-17,21-22,26H,4,6-8H2,1-3,5H3/t9?,10?,12-,13?,14+,16+,17-,20+/m1/s1
InChIKey CFNPAWULBAZKEI-URALZRDDSA-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 398.453 g/mol
Solvent CDCl3
Source File Reference WANG1746