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(5E,5BE)-[5C-(2-PYRIDYL)]-5A-ETHENYLBICYCLOMYCIN
SpectraBase Compound ID 19FP7JsbTEL
InChI InChI=1S/C19H23N3O7/c1-17(27,11-23)14(24)19-16(26)21-18(28,15(25)22-19)12(8-10-29-19)5-4-7-13-6-2-3-9-20-13/h2-7,9,14,23-24,27-28H,8,10-11H2,1H3,(H,21,26)(H,22,25)/b7-4+,12-5+/t14?,17?,18-,19+/m0/s1
InChIKey KRFRPJPUNGJVEA-GWVFMYKFSA-N
Mol Weight 405.41 g/mol
Molecular Formula C19H23N3O7
Exact Mass 405.1536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6U2EvEy9pkm
Name (5E,5BE)-[5C-(2-PYRIDYL)]-5A-ETHENYLBICYCLOMYCIN
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23N3O7
InChI InChI=1S/C19H23N3O7/c1-17(27,11-23)14(24)19-16(26)21-18(28,15(25)22-19)12(8-10-29-19)5-4-7-13-6-2-3-9-20-13/h2-7,9,14,23-24,27-28H,8,10-11H2,1H3,(H,21,26)(H,22,25)/b7-4+,12-5+/t14?,17?,18-,19+/m0/s1
InChIKey KRFRPJPUNGJVEA-GWVFMYKFSA-N
Literature Reference Author F.VINCENT,J.SRINIVASAN,A.SANTILLAN,W.R.WIDGER,H.KOHN
Literature Reference Citation J.ORG.CHEM.,66,2251(2001)
Literature Reference DOI 10.1021/jo0013150
Molecular Weight 405.408 g/mol
Solvent CD3OD
Source File Reference UWLU26277