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6-BETA-O-[2,8-DIMETHYL-(2E,6E)-OCTADIENOYL]-BOSCHNALOSIDE
SpectraBase Compound ID C8u4knIbWsB
InChI InChI=1S/C26H38O11/c1-13(7-8-27)5-4-6-14(2)24(33)35-17-9-15(3)19-20(17)16(10-28)12-34-25(19)37-26-23(32)22(31)21(30)18(11-29)36-26/h6-7,10,12,15,17-23,25-27,29-32H,4-5,8-9,11H2,1-3H3/b13-7+,14-6+/t15-,17-,18+,19?,20?,21+,22-,23+,25+,26-/m1/s1
InChIKey VMDQNTXEPZSLSV-SYWYXDGUSA-N
Mol Weight 526.6 g/mol
Molecular Formula C26H38O11
Exact Mass 526.241412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3okvAokGnDE
Name 6-BETA-O-[2,8-DIMETHYL-(2E,6E)-OCTADIENOYL]-BOSCHNALOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H38O11
InChI InChI=1S/C26H38O11/c1-13(7-8-27)5-4-6-14(2)24(33)35-17-9-15(3)19-20(17)16(10-28)12-34-25(19)37-26-23(32)22(31)21(30)18(11-29)36-26/h6-7,10,12,15,17-23,25-27,29-32H,4-5,8-9,11H2,1-3H3/b13-7+,14-6+/t15-,17-,18+,19?,20?,21+,22-,23+,25+,26-/m1/s1
InChIKey VMDQNTXEPZSLSV-SYWYXDGUSA-N
Literature Reference Author M.S.ABDEL-KADER,F.R.STERMITZ
Literature Reference Citation PHYTOCHEM.,34,1367(1993)
Literature Reference DOI 10.1016/0031-9422(91)80031-U
Molecular Weight 526.581 g/mol
Solvent CD3OD
Source File Reference UWLU20623