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O,O,O,O-TETRA-ACETYL-SECOLOGANIN

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O,O,O,O-TETRA-ACETYL-SECOLOGANIN
SpectraBase Compound ID JtkzfjLP9Ob
InChI InChI=1S/C25H32O14/c1-7-16-17(8-9-26)18(23(31)32-6)10-34-24(16)39-25-22(37-15(5)30)21(36-14(4)29)20(35-13(3)28)19(38-25)11-33-12(2)27/h7,9-10,16-17,19-22,24-25H,1,8,11H2,2-6H3/t16-,17+,19-,20-,21+,22-,24+,25+/m1/s1
InChIKey XQVQOVDNWBXCHM-DYXLYQQMSA-N
Mol Weight 556.5 g/mol
Molecular Formula C25H32O14
Exact Mass 556.179206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I4HstIbmV70
Name O,O,O,O-TETRA-ACETYL-SECOLOGANIN
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H32O14
InChI InChI=1S/C25H32O14/c1-7-16-17(8-9-26)18(23(31)32-6)10-34-24(16)39-25-22(37-15(5)30)21(36-14(4)29)20(35-13(3)28)19(38-25)11-33-12(2)27/h7,9-10,16-17,19-22,24-25H,1,8,11H2,2-6H3/t16-,17+,19-,20-,21+,22-,24+,25+/m1/s1
InChIKey XQVQOVDNWBXCHM-DYXLYQQMSA-N
Literature Reference Author A.PATTHY-LUKATS,A.KOCSIS,L.F.SZABO,B.PODANYI
Literature Reference Citation J.NAT.PROD.,62,1492(1999)
Literature Reference DOI 10.1021/np990150r
Molecular Weight 556.521 g/mol
Solvent CDCl3
Source File Reference UWRU557