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METHYL-GELDANAMYCINATE;ME-GD-MATE

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METHYL-GELDANAMYCINATE;ME-GD-MATE
SpectraBase Compound ID KvV0GgVV0rs
InChI InChI=1S/C30H44N2O10/c1-16(12-20-26(35)21(31)15-22(33)28(20)40-7)13-24(39-6)25(34)18(3)14-19(4)27(42-30(32)37)23(38-5)11-9-10-17(2)29(36)41-8/h9-11,14-16,18,23-25,27,34H,12-13,31H2,1-8H3,(H2,32,37)/b11-9-,17-10+,19-14+/t16-,18+,23+,24+,25-,27+/m1/s1
InChIKey HRKSVRIGRTWRMY-PAHZSGLVSA-N
Mol Weight 592.7 g/mol
Molecular Formula C30H44N2O10
Exact Mass 592.299596 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LKdUlppMlST
Name METHYL-GELDANAMYCINATE;ME-GD-MATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H44N2O10
InChI InChI=1S/C30H44N2O10/c1-16(12-20-26(35)21(31)15-22(33)28(20)40-7)13-24(39-6)25(34)18(3)14-19(4)27(42-30(32)37)23(38-5)11-9-10-17(2)29(36)41-8/h9-11,14-16,18,23-25,27,34H,12-13,31H2,1-8H3,(H2,32,37)/b11-9-,17-10+,19-14+/t16-,18+,23+,24+,25-,27+/m1/s1
InChIKey HRKSVRIGRTWRMY-PAHZSGLVSA-N
Literature Reference Author Z.HU,Y.LIU,Z.Q.TIAN,W.MA,C.M.STARKAS,R.REGENTIN,P.LICARI,D.C .MYLES,C.R.HUTCHINSO
Literature Reference Citation J.ANTIBIOTICS,57,421(2004)
Literature Reference DOI 10.7164/antibiotics.57.421
Molecular Weight 592.687 g/mol
Sample ID 65756
Solvent CD3OD