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THIELAVIN-O;4-[4'-(2'',4''-DIHYDROXY-3'',5'',6''-TRIMETHYLBENZOYLOXY)-3',5',6'-TRIMETHYL-2'-METHOXYBENZOYLOXY]-2-HYDROXY-3,5,6-TRIMETHYLBENZOIC-ACID

View entire compound with spectra: 1 NMR

THIELAVIN-O;4-[4'-(2'',4''-DIHYDROXY-3'',5'',6''-TRIMETHYLBENZOYLOXY)-3',5',6'-TRIMETHYL-2'-METHOXYBENZOYLOXY]-2-HYDROXY-3,5,6-TRIMETHYLBENZOIC-ACID
SpectraBase Compound ID H6m2qQtWCDE
InChI InChI=1S/C31H34O10/c1-11-14(4)23(32)17(7)24(33)21(11)30(37)41-27-16(6)13(3)22(28(39-10)19(27)9)31(38)40-26-15(5)12(2)20(29(35)36)25(34)18(26)8/h32-34H,1-10H3,(H,35,36)
InChIKey KTMLRVZSJWYTKS-UHFFFAOYSA-N
Mol Weight 566.6 g/mol
Molecular Formula C31H34O10
Exact Mass 566.215197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 22Op8kUAPMG
Name THIELAVIN-O;4-[4'-(2'',4''-DIHYDROXY-3'',5'',6''-TRIMETHYLBENZOYLOXY)-3',5',6'-TRIMETHYL-2'-METHOXYBENZOYLOXY]-2-HYDROXY-3,5,6-TRIMETHYLBENZOIC-ACID
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H34O10
InChI InChI=1S/C31H34O10/c1-11-14(4)23(32)17(7)24(33)21(11)30(37)41-27-16(6)13(3)22(28(39-10)19(27)9)31(38)40-26-15(5)12(2)20(29(35)36)25(34)18(26)8/h32-34H,1-10H3,(H,35,36)
InChIKey KTMLRVZSJWYTKS-UHFFFAOYSA-N
Literature Reference Author S.SAKEMI,H.HIRAI,T.ICHIBA,T.INAGAKI,Y.KATO,N.KOJIMA,H.NISHID A,J.C.PARKER,T.SAITO
Literature Reference Citation J.ANTIBIOTICS,55,941(2002)
Literature Reference DOI 10.7164/antibiotics.55.941
Molecular Weight 566.605 g/mol
Solvent C5D5N
Source File Reference UWSI16009