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Trachelosperoside-E-1
SpectraBase Compound ID HvjF0FzsIJz
InChI InChI=1S/C36H58O12/c1-31(2)10-12-35(30(46)48-29-26(43)25(42)24(41)20(15-37)47-29)13-11-33(4)18(23(35)28(31)45)6-7-21-32(3)14-19(40)27(44)36(16-38,17-39)22(32)8-9-34(21,33)5/h6,19-29,37-45H,7-17H2,1-5H3/t19-,20-,21?,22?,23?,24-,25+,26-,27+,28+,29+,32-,33-,34-,35+/m1/s1
InChIKey FSLDBYNJYAUPDI-FIWXFAFXSA-N
Mol Weight 682.8 g/mol
Molecular Formula C36H58O12
Exact Mass 682.392827 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A5T0XPe4rTa
Name TRACHELOSPEROSIDE-E-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O12
InChI InChI=1S/C36H58O12/c1-31(2)10-12-35(30(46)48-29-26(43)25(42)24(41)20(15-37)47-29)13-11-33(4)18(23(35)28(31)45)6-7-21-32(3)14-19(40)27(44)36(16-38,17-39)22(32)8-9-34(21,33)5/h6,19-29,37-45H,7-17H2,1-5H3/t19-,20-,21?,22?,23?,24-,25+,26-,27+,28+,29+,32-,33-,34-,35+/m1/s1
InChIKey FSLDBYNJYAUPDI-FIWXFAFXSA-N
Literature Reference Author F.ABE,T.YAMAUCHI
Literature Reference Citation CHEM.PHARM.BULL.,35,1833(1987)
Literature Reference DOI 10.1248/cpb.35.1833
Molecular Weight 682.849 g/mol
Solvent PYRIDINE-D5
Source File Reference UWBK91