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

View entire compound with spectra: 1 NMR

THIELAVIN-K;4-[4'-(2'',4''-DIHYDROXY-3'',6''-DIMETHYLBENZOYLOXY)-3',5',6'-TRIMETHYL-2'-METHOXYBENZOYLOXY]-2-HYDROXY-3,5,6-TRIMETHYLBENZOIC-ACID
SpectraBase Compound ID Ajj2YJ6u8Us
InChI InChI=1S/C30H32O10/c1-11-10-19(31)16(6)23(32)20(11)29(36)40-26-15(5)13(3)22(27(38-9)18(26)8)30(37)39-25-14(4)12(2)21(28(34)35)24(33)17(25)7/h10,31-33H,1-9H3,(H,34,35)
InChIKey IGYZEKLJQWCRPT-UHFFFAOYSA-N
Mol Weight 552.6 g/mol
Molecular Formula C30H32O10
Exact Mass 552.199547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6iPjYaMzxE5
Name THIELAVIN-K;4-[4'-(2'',4''-DIHYDROXY-3'',6''-DIMETHYLBENZOYLOXY)-3',5',6'-TRIMETHYL-2'-METHOXYBENZOYLOXY]-2-HYDROXY-3,5,6-TRIMETHYLBENZOIC-ACID
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32O10
InChI InChI=1S/C30H32O10/c1-11-10-19(31)16(6)23(32)20(11)29(36)40-26-15(5)13(3)22(27(38-9)18(26)8)30(37)39-25-14(4)12(2)21(28(34)35)24(33)17(25)7/h10,31-33H,1-9H3,(H,34,35)
InChIKey IGYZEKLJQWCRPT-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 552.578 g/mol
Solvent C5D5N
Source File Reference UWSI16005