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O-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-NITRO-BETA-D-GALACTOPYRANOSYL)-N-(BENZOYL)-L-SERINE-METHYLESTER
SpectraBase Compound ID 8lxa6n53FJ8
InChI InChI=1S/C38H40N2O10/c1-45-37(42)31(39-36(41)30-20-12-5-13-21-30)25-49-38-33(40(43)44)35(48-24-29-18-10-4-11-19-29)34(47-23-28-16-8-3-9-17-28)32(50-38)26-46-22-27-14-6-2-7-15-27/h2-21,31-35,38H,22-26H2,1H3,(H,39,41)/t31-,32+,33+,34-,35+,38+/m0/s1
InChIKey DOPRVNGGIYQBJH-IJAGFNHSSA-N
Mol Weight 684.7 g/mol
Molecular Formula C38H40N2O10
Exact Mass 684.268295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LlgLN0hYph3
Name O-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-NITRO-BETA-D-GALACTOPYRANOSYL)-N-(BENZOYL)-L-SERINE-METHYLESTER
Compound Number 21B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H40N2O10
InChI InChI=1S/C38H40N2O10/c1-45-37(42)31(39-36(41)30-20-12-5-13-21-30)25-49-38-33(40(43)44)35(48-24-29-18-10-4-11-19-29)34(47-23-28-16-8-3-9-17-28)32(50-38)26-46-22-27-14-6-2-7-15-27/h2-21,31-35,38H,22-26H2,1H3,(H,39,41)/t31-,32+,33+,34-,35+,38+/m0/s1
InChIKey DOPRVNGGIYQBJH-IJAGFNHSSA-N
Literature Reference Author N.BARROCA,R.R.SCHMIDT
Literature Reference Citation ORG.LETTERS,6,1551(2004)
Literature Reference DOI 10.1021/ol049729t
Molecular Weight 684.743 g/mol
Sample ID 45770
Solvent CDCl3