John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DOaQ3vN2TJl SpectraBase Spectrum ID=1I2vbKl0ei9

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JAVANICOSIDE-L
SpectraBase Compound ID DOaQ3vN2TJl
InChI InChI=1S/C32H46O16/c1-11(2)6-17(34)48-23-25-31-10-44-32(25,29(42)43-5)26(40)22(39)24(31)30(4)8-14(18(35)12(3)13(30)7-16(31)47-27(23)41)45-28-21(38)20(37)19(36)15(9-33)46-28/h6,12-16,18-26,28,33,35-40H,7-10H2,1-5H3/t12-,13-,14+,15-,16+,18-,19-,20+,21-,22+,23+,24+,25+,26-,28-,30-,31+,32-/m0/s1
InChIKey POUGEQYQLBGWLB-YQBKBHIISA-N
Mol Weight 686.7 g/mol
Molecular Formula C32H46O16
Exact Mass 686.278586 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1I2vbKl0ei9
Name JAVANICOSIDE-L
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H46O16
InChI InChI=1S/C32H46O16/c1-11(2)6-17(34)48-23-25-31-10-44-32(25,29(42)43-5)26(40)22(39)24(31)30(4)8-14(18(35)12(3)13(30)7-16(31)47-27(23)41)45-28-21(38)20(37)19(36)15(9-33)46-28/h6,12-16,18-26,28,33,35-40H,7-10H2,1-5H3/t12-,13-,14+,15-,16+,18-,19-,20+,21-,22+,23+,24+,25+,26-,28-,30-,31+,32-/m0/s1
InChIKey POUGEQYQLBGWLB-YQBKBHIISA-N
Literature Reference Author I.H.KIM,Y.HITOTSUYANAGI,K.TAKEYA
Literature Reference Citation PHYTOCHEM.,65,3167(2004)
Literature Reference DOI 10.1016/j.phytochem.2004.08.029
Molecular Weight 686.708 g/mol
Solvent C5D5N
Source File Reference UWSI25624
SpectraBase Batch ID EKVOnkMN0tG