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S-(2-ACETAMIDO-2-DEOXY-3,4,6-TRI-O-ACETYL-ALPHA-D-GALACTOPYRANOSYL)-N-(TERT.-BUTOXYCARBONYL)-L-CYSTEINE-METHYLESTER
SpectraBase Compound ID HktsstGdjlt
InChI InChI=1S/C23H36N2O12S/c1-11(26)24-17-19(35-14(4)29)18(34-13(3)28)16(9-33-12(2)27)36-21(17)38-10-15(20(30)32-8)25-22(31)37-23(5,6)7/h15-19,21H,9-10H2,1-8H3,(H,24,26)(H,25,31)/t15?,16-,17-,18+,19-,21-/m1/s1
InChIKey VHFZKOXQUZVPFC-ZFDAFNFFSA-N
Mol Weight 564.6 g/mol
Molecular Formula C23H36N2O12S
Exact Mass 564.198896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9l3DfkPt5dB
Name S-(2-ACETAMIDO-2-DEOXY-3,4,6-TRI-O-ACETYL-ALPHA-D-GALACTOPYRANOSYL)-N-(TERT.-BUTOXYCARBONYL)-L-CYSTEINE-METHYLESTER
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36N2O12S
InChI InChI=1S/C23H36N2O12S/c1-11(26)24-17-19(35-14(4)29)18(34-13(3)28)16(9-33-12(2)27)36-21(17)38-10-15(20(30)32-8)25-22(31)37-23(5,6)7/h15-19,21H,9-10H2,1-8H3,(H,24,26)(H,25,31)/t15?,16-,17-,18+,19-,21-/m1/s1
InChIKey VHFZKOXQUZVPFC-ZFDAFNFFSA-N
Literature Reference Author S.KNAPP,D.S.MYERS
Literature Reference Citation J.ORG.CHEM.,67,2995(2002)
Literature Reference DOI 10.1021/jo0110909
Molecular Weight 564.605 g/mol
Solvent CDCl3
Source File Reference UWMS23876