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#4A;4-NITROPHENYL_2,3,4,6-TETRA-O-BENZOYL-BETA-D-GALACTOPYRANOSYL-(1->4)-2-PHTHALIMIDO-3-O-ACETYL-6-O-TERT.-BUTYLDIPHENYLSILYL-2-DEOXY-1-THIO-BETA-GLUCOPYRANOS
SpectraBase Compound ID 87c9jcvgEl1
InChI InChI=1S/C72H64N2O18SSi/c1-45(75)86-61-58(73-64(76)54-37-23-24-38-55(54)65(73)77)71(93-51-41-39-50(40-42-51)74(82)83)88-57(44-85-94(72(2,3)4,52-33-19-9-20-34-52)53-35-21-10-22-36-53)59(61)92-70-63(91-69(81)49-31-17-8-18-32-49)62(90-68(80)48-29-15-7-16-30-48)60(89-67(79)47-27-13-6-14-28-47)56(87-70)43-84-66(78)46-25-11-5-12-26-46/h5-42,56-63,70-71H,43-44H2,1-4H3/t56-,57+,58+,59+,60+,61+,62+,63-,70+,71-/m0/s1
InChIKey ZKCBZEUJGRDZAR-RJIUPPQZSA-N
Mol Weight 1305.4 g/mol
Molecular Formula C72H64N2O18SSi
Exact Mass 1304.364411 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ZgiIpovMUv
Name #4A;4-NITROPHENYL_2,3,4,6-TETRA-O-BENZOYL-BETA-D-GALACTOPYRANOSYL-(1->4)-2-PHTHALIMIDO-3-O-ACETYL-6-O-TERT.-BUTYLDIPHENYLSILYL-2-DEOXY-1-THIO-BETA-GLUCOPYRANOS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C72H64N2O18SSi
InChI InChI=1S/C72H64N2O18SSi/c1-45(75)86-61-58(73-64(76)54-37-23-24-38-55(54)65(73)77)71(93-51-41-39-50(40-42-51)74(82)83)88-57(44-85-94(72(2,3)4,52-33-19-9-20-34-52)53-35-21-10-22-36-53)59(61)92-70-63(91-69(81)49-31-17-8-18-32-49)62(90-68(80)48-29-15-7-16-30-48)60(89-67(79)47-27-13-6-14-28-47)56(87-70)43-84-66(78)46-25-11-5-12-26-46/h5-42,56-63,70-71H,43-44H2,1-4H3/t56-,57+,58+,59+,60+,61+,62+,63-,70+,71-/m0/s1
InChIKey ZKCBZEUJGRDZAR-RJIUPPQZSA-N
Literature Reference Author S.CAO,Z.GAN,R.ROY
Literature Reference Citation CARBOHYDR.RES.,318,75(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00080-4
Molecular Weight 1305.448 g/mol
Solvent CDCl3
Source File Reference UWMZ4741