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

*Links on SpectraBase are not permalinks.
VERNCHINILIDE_E;8-ALPHA-(3-CHLORO-2-HYDROXY-2-METHYLPROPANOYLOXY)-10-ALPHA-HYDROXY-1-DESOXYHIRSUTINOLIDE_13-O-ACETATE
SpectraBase Compound ID G3jhwn7ai0b
InChI InChI=1S/C21H27ClO9/c1-11(23)28-9-12-16-13(29-17(12)24)7-19(2)6-5-15(31-19)20(3,26)8-14(16)30-18(25)21(4,27)10-22/h7,14-15,26-27H,5-6,8-10H2,1-4H3/b13-7+/t14?,15-,19+,20?,21?/m1/s1
InChIKey XKHLBANQSXRFRF-RRGNCDMHSA-N
Mol Weight 458.89 g/mol
Molecular Formula C21H27ClO9
Exact Mass 458.13436 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 I3mTtoP0QAQ
Name VERNCHINILIDE_E;8-ALPHA-(3-CHLORO-2-HYDROXY-2-METHYLPROPANOYLOXY)-10-ALPHA-HYDROXY-1-DESOXYHIRSUTINOLIDE_13-O-ACETATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27ClO9
InChI InChI=1S/C21H27ClO9/c1-11(23)28-9-12-16-13(29-17(12)24)7-19(2)6-5-15(31-19)20(3,26)8-14(16)30-18(25)21(4,27)10-22/h7,14-15,26-27H,5-6,8-10H2,1-4H3/b13-7+/t14?,15-,19+,20?,21?/m1/s1
InChIKey XKHLBANQSXRFRF-RRGNCDMHSA-N
Literature Reference Author X.CHEN,Z.J.ZHAN,X.W.ZHANG,J.DING,J.M.YUE
Literature Reference Citation PLANTA.MED.,71,949(2005)
Literature Reference DOI 10.1055/s-2005-871212
Molecular Weight 458.893 g/mol
Solvent CDCl3
Source File Reference UWMZ48096