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LYCOPIC-ACID-B
SpectraBase Compound ID FtN8j1VBjUa
InChI InChI=1S/C36H30O16/c37-21-6-1-18(11-24(21)40)14-29(34(44)45)49-31(43)10-4-17-3-9-27-28(13-17)51-33(32(50-27)20-5-8-23(39)26(42)16-20)36(48)52-30(35(46)47)15-19-2-7-22(38)25(41)12-19/h1-13,16,29-30,32-33,37-42H,14-15H2,(H,44,45)(H,46,47)/b10-4+/t29-,30-,32+,33+/m1/s1
InChIKey MJKIULPREOUSIK-GZVPYPBFSA-N
Mol Weight 718.6 g/mol
Molecular Formula C36H30O16
Exact Mass 718.153385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E0geRSH9PE
Name LYCOPIC-ACID-B
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H30O16
InChI InChI=1S/C36H30O16/c37-21-6-1-18(11-24(21)40)14-29(34(44)45)49-31(43)10-4-17-3-9-27-28(13-17)51-33(32(50-27)20-5-8-23(39)26(42)16-20)36(48)52-30(35(46)47)15-19-2-7-22(38)25(41)12-19/h1-13,16,29-30,32-33,37-42H,14-15H2,(H,44,45)(H,46,47)/b10-4+/t29-,30-,32+,33+/m1/s1
InChIKey MJKIULPREOUSIK-GZVPYPBFSA-N
Literature Reference Author T.MURATA,M.WATAHIKI,Y.TANAKA,T.MIYASE,F.YOSHIZAKI
Literature Reference Citation CHEM.PHARM.BULL.,58,394(2010)
Literature Reference DOI 10.1248/cpb.58.394
Molecular Weight 718.625 g/mol
Sample ID 3419
Solvent ACETONE-D6