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3-BETA,14-DIHYDROXY-COSTUNOLIDE-3-O-BETA-GLUCOPYRANOSYL-14-O-PARA-HYDROXYPHENYLACETATE
SpectraBase Compound ID DebDUtYKv3F
InChI InChI=1S/C29H36O11/c1-15-11-22-20(16(2)28(36)38-22)9-5-18(14-37-24(32)12-17-3-7-19(31)8-4-17)6-10-21(15)39-29-27(35)26(34)25(33)23(13-30)40-29/h3-4,6-8,11,20-23,25-27,29-31,33-35H,2,5,9-10,12-14H2,1H3/b15-11+,18-6-/t20-,21-,22+,23+,25+,26-,27+,29+/m0/s1
InChIKey XASINTHDSBCCBZ-WTNOMZTPSA-N
Mol Weight 560.6 g/mol
Molecular Formula C29H36O11
Exact Mass 560.225762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G1DkzUNlG0l
Name 3-BETA,14-DIHYDROXY-COSTUNOLIDE-3-O-BETA-GLUCOPYRANOSYL-14-O-PARA-HYDROXYPHENYLACETATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36O11
InChI InChI=1S/C29H36O11/c1-15-11-22-20(16(2)28(36)38-22)9-5-18(14-37-24(32)12-17-3-7-19(31)8-4-17)6-10-21(15)39-29-27(35)26(34)25(33)23(13-30)40-29/h3-4,6-8,11,20-23,25-27,29-31,33-35H,2,5,9-10,12-14H2,1H3/b15-11+,18-6-/t20-,21-,22+,23+,25+,26-,27+,29+/m0/s1
InChIKey XASINTHDSBCCBZ-WTNOMZTPSA-N
Literature Reference Author F.BITAM,M.L.CIAVATTA,E.MANZO,A.DIBI,M.GAVAGNIN
Literature Reference Citation PHYTOCHEM.,69,2984(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.09.025
Molecular Weight 560.598 g/mol
Sample ID 63814
Solvent C5D5N