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#9;METHYL-[5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL-(1''->2')-LACTONE]-(2->3)-O-(4,6-DI-O-ACETYL-BETA-D-GALACT
SpectraBase Compound ID ItqiaKYbQ7h
InChI InChI=1S/C57H69NO24/c1-31(59)58-45-41(74-34(4)62)24-57(81-49(45)47(76-36(6)64)43(75-35(5)63)28-68-32(2)60)56(66)80-53-51(82-57)48(77-37(7)65)44(29-69-33(3)61)79-55(53)73-30-42-46(70-25-38-18-12-9-13-19-38)50(71-26-39-20-14-10-15-21-39)52(54(67-8)78-42)72-27-40-22-16-11-17-23-40/h9-23,41-55H,24-30H2,1-8H3,(H,58,59)/t41-,42+,43-,44-,45+,46+,47-,48+,49+,50-,51+,52+,53-,54-,55-,57-/m1/s1
InChIKey QICFUZJCWJSTJL-AGEMOYLPSA-N
Mol Weight 1152.2 g/mol
Molecular Formula C57H69NO24
Exact Mass 1151.420952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EjeSJwh3A3z
Name #9;METHYL-[5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYL-(1''->2')-LACTONE]-(2->3)-O-(4,6-DI-O-ACETYL-BETA-D-GALACT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C57H69NO24
InChI InChI=1S/C57H69NO24/c1-31(59)58-45-41(74-34(4)62)24-57(81-49(45)47(76-36(6)64)43(75-35(5)63)28-68-32(2)60)56(66)80-53-51(82-57)48(77-37(7)65)44(29-69-33(3)61)79-55(53)73-30-42-46(70-25-38-18-12-9-13-19-38)50(71-26-39-20-14-10-15-21-39)52(54(67-8)78-42)72-27-40-22-16-11-17-23-40/h9-23,41-55H,24-30H2,1-8H3,(H,58,59)/t41-,42+,43-,44-,45+,46+,47-,48+,49+,50-,51+,52+,53-,54-,55-,57-/m1/s1
InChIKey QICFUZJCWJSTJL-AGEMOYLPSA-N
Literature Reference Author S.MEHTA,M.GILBERT,W.W.WAKARCHUK,D.M.WHITFIELD
Literature Reference Citation ORG.LETTERS,2,751(2000)
Literature Reference DOI 10.1021/ol990406k
Molecular Weight 1152.167 g/mol
Solvent CDCl3
Source File Reference UWLU33365