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NEOJUSTICIN-C;5-O-DEMETHYL-NEOJUSTICIN-B
SpectraBase Compound ID IGee6q9qM2z
InChI InChI=1S/C21H16O7/c1-24-16-7-11-12(6-14(16)22)20(25-2)19-13(8-26-21(19)23)18(11)10-3-4-15-17(5-10)28-9-27-15/h3-7,22H,8-9H2,1-2H3
InChIKey OGPFHSDGRAWGMY-UHFFFAOYSA-N
Mol Weight 380.35 g/mol
Molecular Formula C21H16O7
Exact Mass 380.089603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIyYPPUZguB
Name NEOJUSTICIN-C;5-O-DEMETHYL-NEOJUSTICIN-B
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16O7
InChI InChI=1S/C21H16O7/c1-24-16-7-11-12(6-14(16)22)20(25-2)19-13(8-26-21(19)23)18(11)10-3-4-15-17(5-10)28-9-27-15/h3-7,22H,8-9H2,1-2H3
InChIKey OGPFHSDGRAWGMY-UHFFFAOYSA-N
Literature Reference Author G.LIU,J.WU,J.SI,J.WANG,M.YANG
Literature Reference Citation MAGN.RES.CHEM.,46,283(2008)
Literature Reference DOI 10.1002/mrc.2175
Molecular Weight 380.354 g/mol
Solvent DMSO-D6
Source File Reference UWIR17444