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METHYL 4-O-BENZYL-2-O-[4-O-BENZYL-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-L-RHAMNOPYRANOSYL]-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-L-RHAMNOPYRANOSIDE
SpectraBase Compound ID 3gwYAHL33e4
InChI InChI=1S/C95H104O19/c1-66-81(100-56-70-38-18-6-19-39-70)85(112-94-89(106-62-76-50-30-12-31-51-76)86(104-60-74-46-26-10-27-47-74)83(102-58-72-42-22-8-23-43-72)78(110-94)64-98-54-68-34-14-4-15-35-68)80(96)92(108-66)114-91-88(82(67(2)109-93(91)97-3)101-57-71-40-20-7-21-41-71)113-95-90(107-63-77-52-32-13-33-53-77)87(105-61-75-48-28-11-29-49-75)84(103-59-73-44-24-9-25-45-73)79(111-95)65-99-55-69-36-16-5-17-37-69/h4-53,66-67,78-96H,54-65H2,1-3H3/t66-,67-,78+,79+,80+,81-,82-,83+,84+,85-,86-,87-,88+,89+,90+,91+,92-,93+,94+,95+/m0/s1
InChIKey SHFSADQRZFGHPL-UVMKGPNTSA-N
Mol Weight 1549.9 g/mol
Molecular Formula C95H104O19
Exact Mass 1548.717181 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3kYuE3XtEi
Name METHYL 4-O-BENZYL-2-O-[4-O-BENZYL-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-L-RHAMNOPYRANOSYL]-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-L-RHAMNOPYRANOSIDE
Comments )
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Formula C95H104O19
InChI InChI=1S/C95H104O19/c1-66-81(100-56-70-38-18-6-19-39-70)85(112-94-89(106-62-76-50-30-12-31-51-76)86(104-60-74-46-26-10-27-47-74)83(102-58-72-42-22-8-23-43-72)78(110-94)64-98-54-68-34-14-4-15-35-68)80(96)92(108-66)114-91-88(82(67(2)109-93(91)97-3)101-57-71-40-20-7-21-41-71)113-95-90(107-63-77-52-32-13-33-53-77)87(105-61-75-48-28-11-29-49-75)84(103-59-73-44-24-9-25-45-73)79(111-95)65-99-55-69-36-16-5-17-37-69/h4-53,66-67,78-96H,54-65H2,1-3H3/t66-,67-,78+,79+,80+,81-,82-,83+,84+,85-,86-,87-,88+,89+,90+,91+,92-,93+,94+,95+/m0/s1
InChIKey SHFSADQRZFGHPL-UVMKGPNTSA-N
Instrument Name Bruker WM-250
Literature Reference L.V.BAKINOVSKY, A.R.GOMTSYAN, N.E.BAIRAMOV, N.K.KOCHETKOV (1985)Bioorganich.Khim.(Russ. Lang.): v.11, N5, 655-661.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3