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Xenicin
SpectraBase Compound ID L722eo1fH3I
InChI InChI=1S/C28H38O9/c1-15(2)11-25(35-19(6)30)27(36-20(7)31)24-14-33-28(37-21(8)32)26-17(4)13-22(34-18(5)29)12-16(3)9-10-23(24)26/h11-12,14,22-23,25-28H,4,9-10,13H2,1-3,5-8H3/b16-12-
InChIKey JTACQGNVQPQYQN-VBKFSLOCSA-N
Mol Weight 518.6 g/mol
Molecular Formula C28H38O9
Exact Mass 518.251583 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BrfwOpfdYd
Name XENICIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38O9
InChI InChI=1S/C28H38O9/c1-15(2)11-25(35-19(6)30)27(36-20(7)31)24-14-33-28(37-21(8)32)26-17(4)13-22(34-18(5)29)12-16(3)9-10-23(24)26/h11-12,14,22-23,25-28H,4,9-10,13H2,1-3,5-8H3/b16-12-
InChIKey JTACQGNVQPQYQN-VBKFSLOCSA-N
Literature Reference Author B.F.BOWDEN,J.C.COLL,E.DITZEL,S.J.MITCHELL,W.T.ROBINSON
Literature Reference Citation AUSTR.J.CHEM.,35,997(1982)
Literature Reference DOI 10.1071/ch9820997
Molecular Weight 518.604 g/mol
Solvent Unknown
Source File Reference UNIW22155