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8-METHOXYCARBONYL-OCTYL-O-(2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-(1->2)-O-(3,4-DI-O-BENZYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-3,4-DI-O-BENZYL-ALPHA-L-RHAMNOP
SpectraBase Compound ID 2dgZF6JJoLU
InChI InChI=1S/C58H77NO16/c1-38-50(67-34-41-23-13-9-14-24-41)52(69-36-43-27-17-11-18-28-43)54(57(71-38)66-32-22-8-6-5-7-21-31-46(62)65-4)75-58-55(74-56-47(59-40(3)61)49(64)48(63)45(33-60)73-56)53(70-37-44-29-19-12-20-30-44)51(39(2)72-58)68-35-42-25-15-10-16-26-42/h9-20,23-30,38-39,45,47-58,60,63-64H,5-8,21-22,31-37H2,1-4H3,(H,59,61)/t38-,39-,45-,47-,48-,49-,50-,51-,52+,53+,54+,55+,56+,57+,58-/m0/s1
InChIKey XXWONPGIBSKEKO-FHAUVCDESA-N
Mol Weight 1044.2 g/mol
Molecular Formula C58H77NO16
Exact Mass 1043.524235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 36dpIeh4vfS
Name 8-METHOXYCARBONYL-OCTYL-O-(2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-(1->2)-O-(3,4-DI-O-BENZYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-3,4-DI-O-BENZYL-ALPHA-L-RHAMNOP
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H77NO16
InChI InChI=1S/C58H77NO16/c1-38-50(67-34-41-23-13-9-14-24-41)52(69-36-43-27-17-11-18-28-43)54(57(71-38)66-32-22-8-6-5-7-21-31-46(62)65-4)75-58-55(74-56-47(59-40(3)61)49(64)48(63)45(33-60)73-56)53(70-37-44-29-19-12-20-30-44)51(39(2)72-58)68-35-42-25-15-10-16-26-42/h9-20,23-30,38-39,45,47-58,60,63-64H,5-8,21-22,31-37H2,1-4H3,(H,59,61)/t38-,39-,45-,47-,48-,49-,50-,51-,52+,53+,54+,55+,56+,57+,58-/m0/s1
InChIKey XXWONPGIBSKEKO-FHAUVCDESA-N
Literature Reference Author S.JOSEPHSON,D.R.BUNDLE
Literature Reference Citation CAN.J.CHEM.,57,3073(1979)
Literature Reference DOI 10.1139/v79-502
Molecular Weight 1044.246 g/mol
Solvent CD3OD
Source File Reference UWED5246