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2,4-DIHYDROXY-6-HEPTYLBENZOIC-ACID-3-HEPTYL-5-HYDROXYPHENYLESTER
SpectraBase Compound ID Jl6QqaGoZeR
InChI InChI=1S/C27H38O5/c1-3-5-7-9-11-13-20-15-22(28)18-24(16-20)32-27(31)26-21(14-12-10-8-6-4-2)17-23(29)19-25(26)30/h15-19,28-30H,3-14H2,1-2H3
InChIKey FJYOXVSNSKDASL-UHFFFAOYSA-N
Mol Weight 442.6 g/mol
Molecular Formula C27H38O5
Exact Mass 442.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID diWY6EBvSx
Name 2,4-DIHYDROXY-6-HEPTYLBENZOIC-ACID-3-HEPTYL-5-HYDROXYPHENYLESTER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O5
InChI InChI=1S/C27H38O5/c1-3-5-7-9-11-13-20-15-22(28)18-24(16-20)32-27(31)26-21(14-12-10-8-6-4-2)17-23(29)19-25(26)30/h15-19,28-30H,3-14H2,1-2H3
InChIKey FJYOXVSNSKDASL-UHFFFAOYSA-N
Literature Reference Author T.YASUZAWA,Y.SAITOH,H.SANO
Literature Reference Citation J.ANTIBIOTICS,43,336(1990)
Literature Reference DOI 10.7164/antibiotics.43.336
Molecular Weight 442.596 g/mol
Sample ID 65857
Solvent CD3OD