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7-BETA-(4-HYDROXY-8-CYANOCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE

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7-BETA-(4-HYDROXY-8-CYANOCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE
SpectraBase Compound ID Cuyj97OyYtI
InChI InChI=1S/C20H17N3O7S/c1-10(24)30-8-13-9-31-19-15(18(27)23(19)16(13)20(28)29)22-17(26)12(7-21)6-11-2-4-14(25)5-3-11/h2-6,15,19,25H,8-9H2,1H3,(H,22,26)(H,28,29)/b12-6+/t15-,19?/m1/s1
InChIKey CGXMQRMBORPFKX-FKEKPXMQSA-N
Mol Weight 443.43 g/mol
Molecular Formula C20H17N3O7S
Exact Mass 443.078721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IEQNcsNwOya
Name 7-BETA-(4-HYDROXY-8-CYANOCINNAMOYL)-AMINO-3-ACETOXYMETHYL-CEPHALOSPORINE
Compound Number 1R
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17N3O7S
InChI InChI=1S/C20H17N3O7S/c1-10(24)30-8-13-9-31-19-15(18(27)23(19)16(13)20(28)29)22-17(26)12(7-21)6-11-2-4-14(25)5-3-11/h2-6,15,19,25H,8-9H2,1H3,(H,22,26)(H,28,29)/b12-6+/t15-,19?/m1/s1
InChIKey CGXMQRMBORPFKX-FKEKPXMQSA-N
Literature Reference Author M.A.LOPEZ,Z.RODRIGUEZ,M.GONZALEZ,B.TOLON,R.AVILA,T.MAMPOSO,H .VELEZ,A.FINI
Literature Reference Citation MAGN.RES.CHEM.,43,261(2005)
Literature Reference DOI 10.1002/mrc.1525
Molecular Weight 443.431 g/mol
Solvent DMSO-D6
Source File Reference UWSI27030