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BAFILOMYCIN_H
SpectraBase Compound ID D7oCqmP4zyl
InChI InChI=1S/C37H62O9/c1-21(2)34-26(7)31(43-12)20-37(44-13,46-34)28(9)33(39)27(8)35-29(41-10)16-14-15-22(3)17-24(5)32(38)25(6)18-23(4)19-30(42-11)36(40)45-35/h14-16,18-19,21,24-29,31-35,38-39H,17,20H2,1-13H3/b16-14+,22-15+,23-18+,30-19-/t24-,25+,26-,27-,28-,29-,31+,32-,33+,34+,35+,37+/m0/s1
InChIKey GBIVMOGRTDNWIQ-XQVGVZLYSA-N
Mol Weight 650.9 g/mol
Molecular Formula C37H62O9
Exact Mass 650.439384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4EyNE75xAoB
Name BAFILOMYCIN_H
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H62O9
InChI InChI=1S/C37H62O9/c1-21(2)34-26(7)31(43-12)20-37(44-13,46-34)28(9)33(39)27(8)35-29(41-10)16-14-15-22(3)17-24(5)32(38)25(6)18-23(4)19-30(42-11)36(40)45-35/h14-16,18-19,21,24-29,31-35,38-39H,17,20H2,1-13H3/b16-14+,22-15+,23-18+,30-19-/t24-,25+,26-,27-,28-,29-,31+,32-,33+,34+,35+,37+/m0/s1
InChIKey GBIVMOGRTDNWIQ-XQVGVZLYSA-N
Literature Reference Author G.CARR,D.E.WILLIAMS,A.R.DIAZ-MARRERO,B.O.PATRICK,H.BOTTRIELL ,A.D.BALGI,E.DONOHUE
Literature Reference Citation J.NAT.PROD.,73,422(2010)
Literature Reference DOI 10.1021/np900632r
Molecular Weight 650.894 g/mol
Sample ID 35089
Solvent C6D6