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XIMAOLIDE_C
SpectraBase Compound ID LCZjOoaxmwb
InChI InChI=1S/C41H63ClO8/c1-23(2)28-20-31(43)26(5)12-10-11-24(3)18-32(44)29-19-27(6)37-30(41(29,22-33(28)45)38(48)49-9)17-25(4)13-14-35(47)40(8)16-15-36(50-40)39(7,42)21-34(37)46/h17,23-24,26,28-30,34-36,46-47H,10-16,18-22H2,1-9H3/b25-17+/t24-,26+,28-,29+,30-,34-,35-,36-,39+,40+,41+/m1/s1
InChIKey RPIADLQRFXRNHC-FTYROXNRSA-N
Mol Weight 719.4 g/mol
Molecular Formula C41H63ClO8
Exact Mass 718.421147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B71Qjlpa9AO
Name XIMAOLIDE_C
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H63ClO8
InChI InChI=1S/C41H63ClO8/c1-23(2)28-20-31(43)26(5)12-10-11-24(3)18-32(44)29-19-27(6)37-30(41(29,22-33(28)45)38(48)49-9)17-25(4)13-14-35(47)40(8)16-15-36(50-40)39(7,42)21-34(37)46/h17,23-24,26,28-30,34-36,46-47H,10-16,18-22H2,1-9H3/b25-17+/t24-,26+,28-,29+,30-,34-,35-,36-,39+,40+,41+/m1/s1
InChIKey RPIADLQRFXRNHC-FTYROXNRSA-N
Literature Reference Author R.JIA,Y.W.GUO,P.CHEN,Y.M.FANG,E.MOLLO,M.GAVAGNIN,G.CIMINO
Literature Reference Citation J.NAT.PROD.,70,1158(2007)
Literature Reference DOI 10.1021/np060220b
Molecular Weight 719.399 g/mol
Sample ID 30630
Solvent CDCl3