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

*Links on SpectraBase are not permalinks.
CIMIFUGIC_ACID_K
SpectraBase Compound ID 6r3rM6OSFKE
InChI InChI=1S/C20H18O9/c21-14-6-1-12(2-7-14)5-10-16(23)29-17(18(24)25)20(28,19(26)27)11-13-3-8-15(22)9-4-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b10-5+/t17-,20+/m1/s1
InChIKey BNBCNSZOUCPLOA-GCIBHZODSA-N
Mol Weight 402.36 g/mol
Molecular Formula C20H18O9
Exact Mass 402.095082 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 JjZWSg6T4zT
Name CIMIFUGIC_ACID_K
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18O9
InChI InChI=1S/C20H18O9/c21-14-6-1-12(2-7-14)5-10-16(23)29-17(18(24)25)20(28,19(26)27)11-13-3-8-15(22)9-4-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b10-5+/t17-,20+/m1/s1
InChIKey BNBCNSZOUCPLOA-GCIBHZODSA-N
Literature Reference Author A.IWANAGA,G.KUSANO,T.WARASHINA,T.MIYASE
Literature Reference Citation J.NAT.PROD.,73,609(2010)
Literature Reference DOI 10.1021/np900752t
Molecular Weight 402.358 g/mol
Sample ID 35214
Solvent CD3OD