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

*Links on SpectraBase are not permalinks.
3-O-ACETYL-4,5-O-DI-(3-METHYLVALERYL)-SHIKIMIC-ACID-METHYLESTER
SpectraBase Compound ID 5cWuT1oIlx7
InChI InChI=1S/C22H34O8/c1-13(2)7-9-19(24)29-18-12-16(22(26)27-6)11-17(28-15(5)23)21(18)30-20(25)10-8-14(3)4/h11,13-14,17-18,21H,7-10,12H2,1-6H3/t17-,18-,21-/m1/s1
InChIKey AJTMPDQHPFUVKI-DBXWQHBBSA-N
Mol Weight 426.5 g/mol
Molecular Formula C22H34O8
Exact Mass 426.225368 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 5SiVj1MmAWM
Name 3-O-ACETYL-4,5-O-DI-(3-METHYLVALERYL)-SHIKIMIC-ACID-METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O8
InChI InChI=1S/C22H34O8/c1-13(2)7-9-19(24)29-18-12-16(22(26)27-6)11-17(28-15(5)23)21(18)30-20(25)10-8-14(3)4/h11,13-14,17-18,21H,7-10,12H2,1-6H3/t17-,18-,21-/m1/s1
InChIKey AJTMPDQHPFUVKI-DBXWQHBBSA-N
Literature Reference Author S.DUPRE,M.J.JAKUPOVIC,F.BOHLMANN,H.M.NIEMEYER
Literature Reference Citation PHYTOCHEM.,30,1211(1991)
Literature Reference DOI 10.1016/S0031-9422(00)95204-X
Molecular Weight 426.507 g/mol
Solvent CDCl3
Source File Reference UWLU34219