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GLYCOSPHINGOLIPID;(2S,3S,4R)-1-O-(BETA-D-GLUCOPYRANOSYL)-2-[(2R,4E)-2-HYDROXY-4-TETRACOSENOYLAMINO]-OCTADECANE-1,3,4-TRIOL

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GLYCOSPHINGOLIPID;(2S,3S,4R)-1-O-(BETA-D-GLUCOPYRANOSYL)-2-[(2R,4E)-2-HYDROXY-4-TETRACOSENOYLAMINO]-OCTADECANE-1,3,4-TRIOL
SpectraBase Compound ID BxVOFUMJaCE
InChI InChI=1S/C48H93NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-41(52)47(57)49-39(38-58-48-46(56)45(55)44(54)42(37-50)59-48)43(53)40(51)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h32,34,39-46,48,50-56H,3-31,33,35-38H2,1-2H3,(H,49,57)/b34-32+/t39-,40-,41+,42-,43+,44-,45+,46-,48-/m0/s1
InChIKey WTZINHVTDPIIMV-CIDQAZLKSA-N
Mol Weight 844.3 g/mol
Molecular Formula C48H93NO10
Exact Mass 843.679948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7cOUQdEqEaN
Name GLYCOSPHINGOLIPID;(2S,3S,4R)-1-O-(BETA-D-GLUCOPYRANOSYL)-2-[(2R,4E)-2-HYDROXY-4-TETRACOSENOYLAMINO]-OCTADECANE-1,3,4-TRIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H93NO10
InChI InChI=1S/C48H93NO10/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-41(52)47(57)49-39(38-58-48-46(56)45(55)44(54)42(37-50)59-48)43(53)40(51)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h32,34,39-46,48,50-56H,3-31,33,35-38H2,1-2H3,(H,49,57)/b34-32+/t39-,40-,41+,42-,43+,44-,45+,46-,48-/m0/s1
InChIKey WTZINHVTDPIIMV-CIDQAZLKSA-N
Literature Reference Author P.MURALIDHAR,N.KRISHNA,M.M.KUMAR,C.B.RAO,D.V.RAO
Literature Reference Citation CHEM.PHARM.BULL.,51,1193(2003)
Literature Reference DOI 10.1248/cpb.51.1193
Molecular Weight 844.267 g/mol
Solvent C5D5N
Source File Reference UWLU20390