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5-O-ALLYL-1-O-(2',3',5'-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-2,3,4-TRI-O-BENZYL-D-RIBITOL
SpectraBase Compound ID CGLv40tsq6a
InChI InChI=1S/C55H54O12/c1-2-33-59-37-46(60-34-40-21-9-3-10-22-40)49(62-36-42-25-13-5-14-26-42)47(61-35-41-23-11-4-12-24-41)38-64-55-51(67-54(58)45-31-19-8-20-32-45)50(66-53(57)44-29-17-7-18-30-44)48(65-55)39-63-52(56)43-27-15-6-16-28-43/h2-32,46-51,55H,1,33-39H2/t46?,47?,48-,49?,50-,51-,55-/m0/s1
InChIKey MDNRKNKQBIGIIP-DVMMOPKDSA-N
Mol Weight 907.0 g/mol
Molecular Formula C55H54O12
Exact Mass 906.361527 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8OU2ygFPMwr
Name 5-O-ALLYL-1-O-(2',3',5'-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-2,3,4-TRI-O-BENZYL-D-RIBITOL
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C55H54O12
InChI InChI=1S/C55H54O12/c1-2-33-59-37-46(60-34-40-21-9-3-10-22-40)49(62-36-42-25-13-5-14-26-42)47(61-35-41-23-11-4-12-24-41)38-64-55-51(67-54(58)45-31-19-8-20-32-45)50(66-53(57)44-29-17-7-18-30-44)48(65-55)39-63-52(56)43-27-15-6-16-28-43/h2-32,46-51,55H,1,33-39H2/t46?,47?,48-,49?,50-,51-,55-/m0/s1
InChIKey MDNRKNKQBIGIIP-DVMMOPKDSA-N
Literature Reference Author J.P.G.HERMANS,L.POOT,M.KLOOSTERMAN,G.A.VANDERMAREL,C.A.A.VAN BOECKEL,D.EVENBERG,J
Literature Reference Citation REC.TR.CH.P.-B.,106,498(1987)
Literature Reference DOI 10.1002/recl.19871060905
Molecular Weight 907.027 g/mol
Solvent CDCl3
Source File Reference UWED1952