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ARALIA-CEREBROSIDE;1-O-BETA-D-GLUCOPYRANOSYL-(2S,3S,4R,8E)-2-[(2'R)-2'-HYDROXYPALMITOYLAMINO]-8-OCTADECENE-1,3,4-TRIOL
SpectraBase Compound ID Dp0CcMf7oms
InChI InChI=1S/C40H77NO10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(43)35(45)31(30-50-40-38(48)37(47)36(46)34(29-42)51-40)41-39(49)33(44)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,31-38,40,42-48H,3-18,20,22-30H2,1-2H3,(H,41,49)/b21-19+/t31-,32-,33?,34-,35+,36-,37+,38-,40-/m0/s1
InChIKey AYBHLNMQTQBJBX-DOZHMMFLSA-N
Mol Weight 732.1 g/mol
Molecular Formula C40H77NO10
Exact Mass 731.554748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPBnbEdFl46
Name ARALIA-CEREBROSIDE;1-O-BETA-D-GLUCOPYRANOSYL-(2S,3S,4R,8E)-2-[(2'R)-2'-HYDROXYPALMITOYLAMINO]-8-OCTADECENE-1,3,4-TRIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H77NO10
InChI InChI=1S/C40H77NO10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(43)35(45)31(30-50-40-38(48)37(47)36(46)34(29-42)51-40)41-39(49)33(44)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,31-38,40,42-48H,3-18,20,22-30H2,1-2H3,(H,41,49)/b21-19+/t31-,32-,33?,34-,35+,36-,37+,38-,40-/m0/s1
InChIKey AYBHLNMQTQBJBX-DOZHMMFLSA-N
Literature Reference Author S.S.KANG,J.S.KIM,Y.N.XU,Y.H.KIM
Literature Reference Citation J.NAT.PROD.,62,1059(1999)
Literature Reference DOI 10.1021/np990018r
Molecular Weight 732.052 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCP8632