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#24;ALLYL-[2-O-ACETYL-3,4,6-TRI-O-BENZYL-ALPHA-D-MANNOPYRANOSYL-(1->6)-[(3,4,6-TRI-O-BENZYL-2-DEOXY-2-TRICHLOROACETAMIDO-BETA-D-GALACTOPYRANOSYL-(1->4)]-2-O-BE
SpectraBase Compound ID 2qqvT0u3Y7Y
InChI InChI=1S/C81H84Cl3NO18/c1-3-44-91-78-75(102-76(87)63-42-26-11-27-43-63)73(96-51-62-40-24-10-25-41-62)70(103-77-67(85-80(88)81(82,83)84)71(94-49-60-36-20-8-21-37-60)68(92-47-58-32-16-6-17-33-58)64(99-77)52-89-45-56-28-12-4-13-29-56)66(101-78)54-97-79-74(98-55(2)86)72(95-50-61-38-22-9-23-39-61)69(93-48-59-34-18-7-19-35-59)65(100-79)53-90-46-57-30-14-5-15-31-57/h3-43,64-75,77-79H,1,44-54H2,2H3,(H,85,88)/t64-,65+,66-,67-,68+,69+,70-,71-,72-,73+,74-,75+,77+,78+,79-/m0/s1
InChIKey BXWPDHISXHSIFI-HONUJICYSA-N
Mol Weight 1465.9 g/mol
Molecular Formula C81H84Cl3NO18
Exact Mass 1463.475398 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDTYBfObFZv
Name #24;ALLYL-[2-O-ACETYL-3,4,6-TRI-O-BENZYL-ALPHA-D-MANNOPYRANOSYL-(1->6)-[(3,4,6-TRI-O-BENZYL-2-DEOXY-2-TRICHLOROACETAMIDO-BETA-D-GALACTOPYRANOSYL-(1->4)]-2-O-BE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C81H84Cl3NO18
InChI InChI=1S/C81H84Cl3NO18/c1-3-44-91-78-75(102-76(87)63-42-26-11-27-43-63)73(96-51-62-40-24-10-25-41-62)70(103-77-67(85-80(88)81(82,83)84)71(94-49-60-36-20-8-21-37-60)68(92-47-58-32-16-6-17-33-58)64(99-77)52-89-45-56-28-12-4-13-29-56)66(101-78)54-97-79-74(98-55(2)86)72(95-50-61-38-22-9-23-39-61)69(93-48-59-34-18-7-19-35-59)65(100-79)53-90-46-57-30-14-5-15-31-57/h3-43,64-75,77-79H,1,44-54H2,2H3,(H,85,88)/t64-,65+,66-,67-,68+,69+,70-,71-,72-,73+,74-,75+,77+,78+,79-/m0/s1
InChIKey BXWPDHISXHSIFI-HONUJICYSA-N
Literature Reference Author K.PEKARI,D.TAILLER,R.WEINGART,R.R.SCHMIDT
Literature Reference Citation J.ORG.CHEM.,66,7432(2001)
Literature Reference DOI 10.1021/jo015840q
Molecular Weight 1465.913 g/mol
Solvent Unknown
Source File Reference UWLU28552