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KS-502;2-(BETA-D-GALACTOFURANOSYLOXY)-6-HEPTYL-4-HYDROXYBENZOIC-ACID-4-CARBOXY-3-HEPTYL-5-HYDROXYPHENYLESTER

View entire compound with spectra: 1 NMR

KS-502;2-(BETA-D-GALACTOFURANOSYLOXY)-6-HEPTYL-4-HYDROXYBENZOIC-ACID-4-CARBOXY-3-HEPTYL-5-HYDROXYPHENYLESTER
SpectraBase Compound ID 8jKrbtbREfw
InChI InChI=1S/C34H48O12/c1-3-5-7-9-11-13-20-15-22(36)17-26(45-34-30(40)29(39)31(46-34)25(38)19-35)28(20)33(43)44-23-16-21(14-12-10-8-6-4-2)27(32(41)42)24(37)18-23/h15-18,25,29-31,34-40H,3-14,19H2,1-2H3,(H,41,42)/t25-,29-,30-,31+,34-/m0/s1
InChIKey DXFBFWMLNIWYDA-ZZGJWOPWSA-N
Mol Weight 648.7 g/mol
Molecular Formula C34H48O12
Exact Mass 648.314577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hvw6gJ1Q296
Name KS-502;2-(BETA-D-GALACTOFURANOSYLOXY)-6-HEPTYL-4-HYDROXYBENZOIC-ACID-4-CARBOXY-3-HEPTYL-5-HYDROXYPHENYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H48O12
InChI InChI=1S/C34H48O12/c1-3-5-7-9-11-13-20-15-22(36)17-26(45-34-30(40)29(39)31(46-34)25(38)19-35)28(20)33(43)44-23-16-21(14-12-10-8-6-4-2)27(32(41)42)24(37)18-23/h15-18,25,29-31,34-40H,3-14,19H2,1-2H3,(H,41,42)/t25-,29-,30-,31+,34-/m0/s1
InChIKey DXFBFWMLNIWYDA-ZZGJWOPWSA-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 648.748 g/mol
Sample ID 65852
Solvent CD3OD