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Pseudomonic acid, A methyl ester acetonide derivative

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Pseudomonic acid, A methyl ester acetonide derivative
SpectraBase Compound ID Hm3jRxOPCyc
InChI InChI=1S/C30H50O9/c1-19(16-26(33)35-14-12-10-8-7-9-11-13-25(32)34-6)15-23-29-28(38-30(4,5)39-29)22(18-36-23)17-24-27(37-24)20(2)21(3)31/h16,20-24,27-29,31H,7-15,17-18H2,1-6H3/b19-16+
InChIKey KPIGPRHVFOOIBD-KNTRCKAVSA-N
Mol Weight 554.7 g/mol
Molecular Formula C30H50O9
Exact Mass 554.345483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQDODuuil0Z
Name Pseudomonic acid, A methyl ester acetonide derivative
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H50O9
InChI InChI=1S/C30H50O9/c1-19(16-26(33)35-14-12-10-8-7-9-11-13-25(32)34-6)15-23-29-28(38-30(4,5)39-29)22(18-36-23)17-24-27(37-24)20(2)21(3)31/h16,20-24,27-29,31H,7-15,17-18H2,1-6H3/b19-16+
InChIKey KPIGPRHVFOOIBD-KNTRCKAVSA-N
Instrument Name Varian XL-100
Literature Reference T.C. Feline, R.B. Jones, G. Mellows, J. Chem. Soc. Perkin I 309 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3