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(6R,7R)-7-[(Z)-2-(2-AMINOTHIAZOL-4-YL)-2-[(1-METHOXYCABONYL-1-METHYLETHOXY)-IMINO]-ACETYL]-AMINO]-8-OXO-3-[(1-PYRIDINO)-METHYL]-5-THIA-1-AZABICYCLO-[4.2
SpectraBase Compound ID B8HkWFxmOj5
InChI InChI=1S/C23H24N6O7S2/c1-23(2,21(34)35-3)36-27-14(13-11-38-22(24)25-13)17(30)26-15-18(31)29-16(20(32)33)12(10-37-19(15)29)9-28-7-5-4-6-8-28/h4-8,11,15,19H,9-10H2,1-3H3,(H3-,24,25,26,30,32,33)/b27-14+/t15-,19-/m1/s1
InChIKey SQQLCFFMLJEMPT-GPQTWHBLSA-N
Mol Weight 560.6 g/mol
Molecular Formula C23H24N6O7S2
Exact Mass 560.114789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1f75TYfboTU
Name (6R,7R)-7-[(Z)-2-(2-AMINOTHIAZOL-4-YL)-2-[(1-METHOXYCABONYL-1-METHYLETHOXY)-IMINO]-ACETYL]-AMINO]-8-OXO-3-[(1-PYRIDINO)-METHYL]-5-THIA-1-AZABICYCLO-[4.2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H24N6O7S2
InChI InChI=1S/C23H24N6O7S2/c1-23(2,21(34)35-3)36-27-14(13-11-38-22(24)25-13)17(30)26-15-18(31)29-16(20(32)33)12(10-37-19(15)29)9-28-7-5-4-6-8-28/h4-8,11,15,19H,9-10H2,1-3H3,(H3-,24,25,26,30,32,33)/b27-14+/t15-,19-/m1/s1
InChIKey SQQLCFFMLJEMPT-GPQTWHBLSA-N
Literature Reference Author B.QU,B.L.OU,D.Y.CHEN,Y.Z.HU
Literature Reference Citation J.FOOD.DRUG.ANAL.,18,346(2010)
Molecular Weight 560.600 g/mol
Sample ID 70810
Solvent DMSO-D6