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TRIDEUTEROMETHYL-3,5-DIHYDROXY-7-[1,2,3,5,6,7,8,8A-OCTAHYDRO-3,5-DIHYDROXY-2,6-DIMETHYL-8-(2-METHYLBUTYRYLOXY)-NAPHTHALEN-1-YL]-HEPTANOATE

View entire compound with spectra: 1 NMR

TRIDEUTEROMETHYL-3,5-DIHYDROXY-7-[1,2,3,5,6,7,8,8A-OCTAHYDRO-3,5-DIHYDROXY-2,6-DIMETHYL-8-(2-METHYLBUTYRYLOXY)-NAPHTHALEN-1-YL]-HEPTANOATE
SpectraBase Compound ID AWwGGoK3gLx
InChI InChI=1S/C25H42O8/c1-6-13(2)25(31)33-21-9-14(3)24(30)19-12-20(28)15(4)18(23(19)21)8-7-16(26)10-17(27)11-22(29)32-5/h12-18,20-21,23-24,26-28,30H,6-11H2,1-5H3/t13-,14-,15-,16+,17-,18+,20-,21+,23-,24+/m0/s1/i5D3,23D
InChIKey MPHFITJIUJCRLW-FGOKPCGWSA-N
Mol Weight 474.6 g/mol
Molecular Formula C25H382H4O8
Exact Mass 474.313075 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cd5d0DCVPob
Name TRIDEUTEROMETHYL-3,5-DIHYDROXY-7-[1,2,3,5,6,7,8,8A-OCTAHYDRO-3,5-DIHYDROXY-2,6-DIMETHYL-8-(2-METHYLBUTYRYLOXY)-NAPHTHALEN-1-YL]-HEPTANOATE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H382H4O8
InChI InChI=1S/C25H42O8/c1-6-13(2)25(31)33-21-9-14(3)24(30)19-12-20(28)15(4)18(23(19)21)8-7-16(26)10-17(27)11-22(29)32-5/h12-18,20-21,23-24,26-28,30H,6-11H2,1-5H3/t13-,14-,15-,16+,17-,18+,20-,21+,23-,24+/m0/s1/i5D3,23D
InChIKey MPHFITJIUJCRLW-FGOKPCGWSA-N
Literature Reference Author A.JEKKEL,A.KONYA,E.ILKOEY,S.BOROS,G.HORVATH,J.SUETOE
Literature Reference Citation J.ANTIBIOTICS,50,750(1997)
Literature Reference DOI 10.7164/antibiotics.50.750
Molecular Weight 474.628 g/mol
Solvent CD3OD
Source File Reference UWCS25468