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ASPERULOSIDIC-ACID
SpectraBase Compound ID Ip73AOtwCm
InChI InChI=1S/C18H24O12/c1-6(20)27-4-7-2-9(21)12-8(16(25)26)5-28-17(11(7)12)30-18-15(24)14(23)13(22)10(3-19)29-18/h2,5,9-15,17-19,21-24H,3-4H2,1H3,(H,25,26)/t9-,10-,11+,12-,13-,14+,15-,17-,18+/m0/s1
InChIKey DGDWCRWJRNMRKX-OKEASSFKSA-N
Mol Weight 432.38 g/mol
Molecular Formula C18H24O12
Exact Mass 432.126776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxEqz1bxv5f
Name ASPERULOSIDIC-ACID
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24O12
InChI InChI=1S/C18H24O12/c1-6(20)27-4-7-2-9(21)12-8(16(25)26)5-28-17(11(7)12)30-18-15(24)14(23)13(22)10(3-19)29-18/h2,5,9-15,17-19,21-24H,3-4H2,1H3,(H,25,26)/t9-,10-,11+,12-,13-,14+,15-,17-,18+/m0/s1
InChIKey DGDWCRWJRNMRKX-OKEASSFKSA-N
Literature Reference Author B.LI,D.M.ZHANG,Y.M.LUO,X.G.CHEN
Literature Reference Citation CHEM.PHARM.BULL.,54,297(2006)
Literature Reference DOI 10.1248/cpb.54.297
Molecular Weight 432.381 g/mol
Sample ID 36980
Solvent CD3OD