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(7R)-O-METHYL-ISOHAENKEANOSIDE-TETRAACETATE
SpectraBase Compound ID 3vwNLAkL1xC
InChI InChI=1S/C35H42O17/c1-17-29-24(14-28(42-6)46-17)25(33(41)43-7)15-45-34(29)52-35-32(50-21(5)39)31(49-20(4)38)30(48-19(3)37)26(51-35)16-44-27(40)13-10-22-8-11-23(12-9-22)47-18(2)36/h8-13,15,17,24,26,28-32,34-35H,14,16H2,1-7H3/b13-10+/t17-,24?,26-,28-,29?,30-,31+,32-,34-,35+/m0/s1
InChIKey QTNNHBQYDNKZIP-PXJGRKHGSA-N
Mol Weight 734.7 g/mol
Molecular Formula C35H42O17
Exact Mass 734.2422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJICT2IxvcX
Name (7R)-O-METHYL-ISOHAENKEANOSIDE-TETRAACETATE
Compound Number 174
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H42O17
InChI InChI=1S/C35H42O17/c1-17-29-24(14-28(42-6)46-17)25(33(41)43-7)15-45-34(29)52-35-32(50-21(5)39)31(49-20(4)38)30(48-19(3)37)26(51-35)16-44-27(40)13-10-22-8-11-23(12-9-22)47-18(2)36/h8-13,15,17,24,26,28-32,34-35H,14,16H2,1-7H3/b13-10+/t17-,24?,26-,28-,29?,30-,31+,32-,34-,35+/m0/s1
InChIKey QTNNHBQYDNKZIP-PXJGRKHGSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,54,1173(1991)
Literature Reference DOI 10.1021/np50077a001
Molecular Weight 734.708 g/mol
Solvent CDCl3
Source File Reference UWCS4545