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1,5,9-EPIDEOXYLOGANIC-ACID-SODIUM-SALT

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1,5,9-EPIDEOXYLOGANIC-ACID-SODIUM-SALT
SpectraBase Compound ID 7AbGkezoMQJ
InChI InChI=1S/C16H24O9.Na/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16;/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22);/q;+1/p-1/t6-,7-,9-,10-,11-,12+,13-,15+,16+;/m0./s1
InChIKey BOLSKXRWQJWPGI-LYRCJPRZSA-M
Mol Weight 382.34 g/mol
Molecular Formula C16H23NaO9
Exact Mass 382.123977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JbsUMFlRjzR
Name 1,5,9-EPIDEOXYLOGANIC-ACID-SODIUM-SALT
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23NaO9
InChI InChI=1S/C16H24O9.Na/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16;/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22);/q;+1/p-1/t6-,7-,9-,10-,11-,12+,13-,15+,16+;/m0./s1
InChIKey BOLSKXRWQJWPGI-LYRCJPRZSA-M
Literature Reference Author Y.TAKEDA,Y.OOISO,T.MASUDA,G.HONDA,H.OTSUKA,E.SEZIK,E.YESILAD A
Literature Reference Citation PHYTOCHEM.,49,787(1998)
Literature Reference DOI 10.1016/S0031-9422(98)00125-3
Molecular Weight 382.343 g/mol
Solvent CD3OD
Source File Reference UWLU311