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CHOLESTERYL-3,4,6-TRI-O-BENZYL-2-DEOXY-ALPHA-D-ARABINO-HEXOPYRANOSIDE

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CHOLESTERYL-3,4,6-TRI-O-BENZYL-2-DEOXY-ALPHA-D-ARABINO-HEXOPYRANOSIDE
SpectraBase Compound ID KLvsouGzRrX
InChI InChI=1S/C54H74O5/c1-38(2)16-15-17-39(3)46-26-27-47-45-25-24-43-32-44(28-30-53(43,4)48(45)29-31-54(46,47)5)58-51-33-49(56-35-41-20-11-7-12-21-41)52(57-36-42-22-13-8-14-23-42)50(59-51)37-55-34-40-18-9-6-10-19-40/h6-14,18-24,38-39,44-52H,15-17,25-37H2,1-5H3/t39-,44+,45+,46-,47-,48+,49-,50-,51+,52+,53+,54-/m1/s1
InChIKey DDDUMAVYAFHRRT-FQBWHKOHSA-N
Mol Weight 803.2 g/mol
Molecular Formula C54H74O5
Exact Mass 802.553625 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G5Kv4yTwPPF
Name CHOLESTERYL-3,4,6-TRI-O-BENZYL-2-DEOXY-ALPHA-D-ARABINO-HEXOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H74O5
InChI InChI=1S/C54H74O5/c1-38(2)16-15-17-39(3)46-26-27-47-45-25-24-43-32-44(28-30-53(43,4)48(45)29-31-54(46,47)5)58-51-33-49(56-35-41-20-11-7-12-21-41)52(57-36-42-22-13-8-14-23-42)50(59-51)37-55-34-40-18-9-6-10-19-40/h6-14,18-24,38-39,44-52H,15-17,25-37H2,1-5H3/t39-,44+,45+,46-,47-,48+,49-,50-,51+,52+,53+,54-/m1/s1
InChIKey DDDUMAVYAFHRRT-FQBWHKOHSA-N
Literature Reference Author A.P.RAUTER,T.ALMEIDA,A.I.VICENTE,V.RIBEIRO,J.C.BORDADO,J.P.M ARQUES,F.R.RIBEIRO,M
Literature Reference Citation EUR.J.ORG.CHEM.,2429(2006)
Molecular Weight 803.179 g/mol
Sample ID 44914
Solvent CDCl3