For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
METHYL-(PHENYL-4-O-ACETYL-2,3-DI-O-BENZYL-1-THIO-BETA-D-GALACTOPYRANOSID)-URONATE
SpectraBase Compound ID 4Je0a65199u
InChI InChI=1S/C29H30O7S/c1-20(30)35-25-24(33-18-21-12-6-3-7-13-21)27(34-19-22-14-8-4-9-15-22)29(36-26(25)28(31)32-2)37-23-16-10-5-11-17-23/h3-17,24-27,29H,18-19H2,1-2H3/t24-,25+,26-,27+,29-/m1/s1
InChIKey WPMQRFCQIBPVEH-NWFYCVFPSA-N
Mol Weight 522.61 g/mol
Molecular Formula C29H30O7S
Exact Mass 522.171224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6IRqCwbh5Z7
Name METHYL-(PHENYL-4-O-ACETYL-2,3-DI-O-BENZYL-1-THIO-BETA-D-GALACTOPYRANOSID)-URONATE
Compound Number 44
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H30O7S
InChI InChI=1S/C29H30O7S/c1-20(30)35-25-24(33-18-21-12-6-3-7-13-21)27(34-19-22-14-8-4-9-15-22)29(36-26(25)28(31)32-2)37-23-16-10-5-11-17-23/h3-17,24-27,29H,18-19H2,1-2H3/t24-,25+,26-,27+,29-/m1/s1
InChIKey WPMQRFCQIBPVEH-NWFYCVFPSA-N
Literature Reference Author L.J.V.D.BOS,J.D.C.CODEE,J.C.V.D.TOORN,T.J.BOLTJE,J.H.V.BOOM, H.S.OVERKLEEFT,G.A.V
Literature Reference Citation ORG.LETTERS,6,2165(2004)
Literature Reference DOI 10.1021/ol049380+
Molecular Weight 522.613 g/mol
Sample ID 38904
Solvent CDCl3