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(+)-SCLEROTIORIN
SpectraBase Compound ID H3FbozuAdBB
InChI InChI=1S/C21H23ClO5/c1-6-12(2)9-13(3)7-8-15-10-16-17(11-26-15)19(24)21(5,27-14(4)23)20(25)18(16)22/h7-12H,6H2,1-5H3/b8-7+,13-9+/t12-,21+/m1/s1
InChIKey SWJLTKXURNHVHE-OCYPSCKBSA-N
Mol Weight 390.86 g/mol
Molecular Formula C21H23ClO5
Exact Mass 390.123402 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HLsQyzMH2Le
Name (+)-SCLEROTIORIN
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23ClO5
InChI InChI=1S/C21H23ClO5/c1-6-12(2)9-13(3)7-8-15-10-16-17(11-26-15)19(24)21(5,27-14(4)23)20(25)18(16)22/h7-12H,6H2,1-5H3/b8-7+,13-9+/t12-,21+/m1/s1
InChIKey SWJLTKXURNHVHE-OCYPSCKBSA-N
Literature Reference Author L.PAIRET,S.K.WRIGLEY,I.CHETLAND,E.E.REYNOLDS,M.A.HAYES,J.HOL LOWAY,A.M.AINSWORTH,
Literature Reference Citation J.ANTIBIOTICS,48,913(1995)
Literature Reference DOI 10.7164/antibiotics.48.913
Molecular Weight 390.864 g/mol
Solvent CDCl3
Source File Reference UWCS25677