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#26;METHYL-2-ACETAMIDO-6-O-BENZYL-3-O-(2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL)-2-DEOXY-4-O-(4-O-METHYL-2,3,6-TRI-O-PIVALOYL-BETA-D-GALACTOPYRANOSYL)-B
SpectraBase Compound ID m7h7ZRv2gZ
InChI InChI=1S/C65H87NO18/c1-40-49(74-35-43-28-20-15-21-29-43)53(75-36-44-30-22-16-23-31-44)55(76-37-45-32-24-17-25-33-45)58(78-40)82-52-48(66-41(2)67)57(72-13)79-46(38-73-34-42-26-18-14-19-27-42)51(52)81-59-56(84-62(70)65(9,10)11)54(83-61(69)64(6,7)8)50(71-12)47(80-59)39-77-60(68)63(3,4)5/h14-33,40,46-59H,34-39H2,1-13H3,(H,66,67)/t40-,46-,47-,48-,49+,50+,51-,52-,53+,54+,55-,56-,57-,58-,59+/m1/s1
InChIKey VMYLVVBXRRGKCE-QVVUWUSBSA-N
Mol Weight 1170.4 g/mol
Molecular Formula C65H87NO18
Exact Mass 1169.592315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 76VPRFf8rl1
Name #26;METHYL-2-ACETAMIDO-6-O-BENZYL-3-O-(2,3,4-TRI-O-BENZYL-ALPHA-L-FUCOPYRANOSYL)-2-DEOXY-4-O-(4-O-METHYL-2,3,6-TRI-O-PIVALOYL-BETA-D-GALACTOPYRANOSYL)-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C65H87NO18
InChI InChI=1S/C65H87NO18/c1-40-49(74-35-43-28-20-15-21-29-43)53(75-36-44-30-22-16-23-31-44)55(76-37-45-32-24-17-25-33-45)58(78-40)82-52-48(66-41(2)67)57(72-13)79-46(38-73-34-42-26-18-14-19-27-42)51(52)81-59-56(84-62(70)65(9,10)11)54(83-61(69)64(6,7)8)50(71-12)47(80-59)39-77-60(68)63(3,4)5/h14-33,40,46-59H,34-39H2,1-13H3,(H,66,67)/t40-,46-,47-,48-,49+,50+,51-,52-,53+,54+,55-,56-,57-,58-,59+/m1/s1
InChIKey VMYLVVBXRRGKCE-QVVUWUSBSA-N
Literature Reference Author C.J.MOORE,F.I.AUZANNEAU
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1134(2012)
Literature Reference DOI 10.3762/bjoc.8.126
Molecular Weight 1170.402 g/mol
Solvent CDCl3
Source File Reference UWIR10938