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METHYL-2,3-DI-O-ACETYL-4-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-6-O-(TRIPHENYLMETHYL)-ALPHA-D-ALTROPYRANOSIDE
SpectraBase Compound ID K3mkTrCCnQ0
InChI InChI=1S/C64H66O13/c1-45(65)73-59-57(55(75-62(67-3)61(59)74-46(2)66)44-72-64(51-33-19-8-20-34-51,52-35-21-9-22-36-52)53-37-23-10-24-38-53)77-63-60(71-42-50-31-17-7-18-32-50)58(70-41-49-29-15-6-16-30-49)56(69-40-48-27-13-5-14-28-48)54(76-63)43-68-39-47-25-11-4-12-26-47/h4-38,54-63H,39-44H2,1-3H3/t54-,55-,56-,57+,58+,59-,60-,61+,62+,63-/m1/s1
InChIKey GQLKQQPEBKYYPW-YCTHQDKOSA-N
Mol Weight 1043.2 g/mol
Molecular Formula C64H66O13
Exact Mass 1042.450342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ty1tXbHatr
Name METHYL-2,3-DI-O-ACETYL-4-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-6-O-(TRIPHENYLMETHYL)-ALPHA-D-ALTROPYRANOSIDE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C64H66O13
InChI InChI=1S/C64H66O13/c1-45(65)73-59-57(55(75-62(67-3)61(59)74-46(2)66)44-72-64(51-33-19-8-20-34-51,52-35-21-9-22-36-52)53-37-23-10-24-38-53)77-63-60(71-42-50-31-17-7-18-32-50)58(70-41-49-29-15-6-16-30-49)56(69-40-48-27-13-5-14-28-48)54(76-63)43-68-39-47-25-11-4-12-26-47/h4-38,54-63H,39-44H2,1-3H3/t54-,55-,56-,57+,58+,59-,60-,61+,62+,63-/m1/s1
InChIKey GQLKQQPEBKYYPW-YCTHQDKOSA-N
Literature Reference Author E.BOZO,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,77,745(1994)
Literature Reference DOI 10.1002/hlca.19940770316
Molecular Weight 1043.220 g/mol
Solvent CDCl3
Source File Reference UWPR1396