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

*Links on SpectraBase are not permalinks.
METASEGLYPTORIN_A;3,4-SECOCYCLOARTA-4-HYDROXY-24-ETHYL-25-EN-3-OIC_ACID
SpectraBase Compound ID 8BjBcOagn6T
InChI InChI=1S/C32H54O3/c1-9-23(21(2)3)11-10-22(4)24-14-16-30(8)26-13-12-25(28(5,6)35)31(17-15-27(33)34)20-32(26,31)19-18-29(24,30)7/h22-26,35H,2,9-20H2,1,3-8H3,(H,33,34)/t22-,23?,24-,25+,26+,29-,30+,31-,32+/m1/s1
InChIKey XKNFVOLVUYNREE-JEWLOWAJSA-N
Mol Weight 486.8 g/mol
Molecular Formula C32H54O3
Exact Mass 486.407296 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 BKnAzCPbULn
Name METASEGLYPTORIN_A;3,4-SECOCYCLOARTA-4-HYDROXY-24-ETHYL-25-EN-3-OIC_ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H54O3
InChI InChI=1S/C32H54O3/c1-9-23(21(2)3)11-10-22(4)24-14-16-30(8)26-13-12-25(28(5,6)35)31(17-15-27(33)34)20-32(26,31)19-18-29(24,30)7/h22-26,35H,2,9-20H2,1,3-8H3,(H,33,34)/t22-,23?,24-,25+,26+,29-,30+,31-,32+/m1/s1
InChIKey XKNFVOLVUYNREE-JEWLOWAJSA-N
Literature Reference Author L.B.DONG,J.HE,Y.Y.WANG,X.D.WU,X.DENG,Z.H.PAN,G.XU,L.Y.PENG,Y .ZHAO,Y.LI,X.GONG,Q.
Literature Reference Citation J.NAT.PROD.,74,234(2011)
Literature Reference DOI 10.1021/np100694k
Molecular Weight 486.779 g/mol
Sample ID 37625
Solvent CDCl3