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2'-O-COUMAROYL-8-EPI-TECOMOSIDE
SpectraBase Compound ID mdTT7sQUai
InChI InChI=1S/C25H30O12/c1-12-16(29)8-25(33)14(9-26)11-34-23(19(12)25)37-24-22(21(32)20(31)17(10-27)35-24)36-18(30)7-4-13-2-5-15(28)6-3-13/h2-7,9,11-12,16-17,19-24,27-29,31-33H,8,10H2,1H3/b7-4+/t12-,16+,17+,19+,20+,21-,22+,23+,24-,25+/m1/s1
InChIKey HYYGYDZKTMHQAW-WEUVBNEVSA-N
Mol Weight 522.5 g/mol
Molecular Formula C25H30O12
Exact Mass 522.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7KDEmUSzfUh
Name 2'-O-COUMAROYL-8-EPI-TECOMOSIDE
Compound Number 126
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O12
InChI InChI=1S/C25H30O12/c1-12-16(29)8-25(33)14(9-26)11-34-23(19(12)25)37-24-22(21(32)20(31)17(10-27)35-24)36-18(30)7-4-13-2-5-15(28)6-3-13/h2-7,9,11-12,16-17,19-24,27-29,31-33H,8,10H2,1H3/b7-4+/t12-,16+,17+,19+,20+,21-,22+,23+,24-,25+/m1/s1
InChIKey HYYGYDZKTMHQAW-WEUVBNEVSA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,159(2007)
Literature Reference DOI 10.1248/cpb.55.159
Molecular Weight 522.506 g/mol
Sample ID 37922
Solvent CD3OD