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ETHYL-2-O-(3'-O-ACETYL-2',4'-DI-O-BENZYL-ALPHA-D-RHAMNOPYRANOSYL)-3,4-DI-O-BENZYL-1-THIO-ALPHA-D-RHAMNOPYRANOSIDE
SpectraBase Compound ID CCtmwFJl34T
InChI InChI=1S/C44H52O9S/c1-5-54-44-42(39(48-28-35-22-14-8-15-23-35)37(31(3)51-44)46-26-33-18-10-6-11-19-33)53-43-41(49-29-36-24-16-9-17-25-36)40(52-32(4)45)38(30(2)50-43)47-27-34-20-12-7-13-21-34/h6-25,30-31,37-44H,5,26-29H2,1-4H3/t30-,31+,37+,38-,39-,40+,41+,42-,43-,44+/m0/s1
InChIKey XOWJXQSCFZMNQJ-POUMGHKHSA-N
Mol Weight 757.0 g/mol
Molecular Formula C44H52O9S
Exact Mass 756.333204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HxKj5tyRqNV
Name ETHYL-2-O-(3'-O-ACETYL-2',4'-DI-O-BENZYL-ALPHA-D-RHAMNOPYRANOSYL)-3,4-DI-O-BENZYL-1-THIO-ALPHA-D-RHAMNOPYRANOSIDE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H52O9S
InChI InChI=1S/C44H52O9S/c1-5-54-44-42(39(48-28-35-22-14-8-15-23-35)37(31(3)51-44)46-26-33-18-10-6-11-19-33)53-43-41(49-29-36-24-16-9-17-25-36)40(52-32(4)45)38(30(2)50-43)47-27-34-20-12-7-13-21-34/h6-25,30-31,37-44H,5,26-29H2,1-4H3/t30-,31+,37+,38-,39-,40+,41+,42-,43-,44+/m0/s1
InChIKey XOWJXQSCFZMNQJ-POUMGHKHSA-N
Literature Reference Author W.ZOU,A.J.SEN,W.A.SZAREK,D.B.MACLEAN
Literature Reference Citation CAN.J.CHEM.,71,2194(1993)
Literature Reference DOI 10.1139/v93-275
Molecular Weight 756.951 g/mol
Solvent CDCl3
Source File Reference UWVP5728