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ISOSCOPARIN_K;7-ALPHA,11-BETA,14-BETA,15-BETA-TETRAHYDROXY-ENT-KAUR-16-EN-1-ONE
SpectraBase Compound ID EAtBjAsa4nm
InChI InChI=1S/C20H30O5/c1-9-10-7-11(21)15-19(4)12(18(2,3)6-5-13(19)22)8-14(23)20(15,16(9)24)17(10)25/h10-12,14-17,21,23-25H,1,5-8H2,2-4H3/t10-,11-,12+,14+,15-,16+,17+,19-,20+/m0/s1
InChIKey IEMWQOKNVXLTGS-XCFIXVDISA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EC7D3CYPDFg
Name ISOSCOPARIN_K;7-ALPHA,11-BETA,14-BETA,15-BETA-TETRAHYDROXY-ENT-KAUR-16-EN-1-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-9-10-7-11(21)15-19(4)12(18(2,3)6-5-13(19)22)8-14(23)20(15,16(9)24)17(10)25/h10-12,14-17,21,23-25H,1,5-8H2,2-4H3/t10-,11-,12+,14+,15-,16+,17+,19-,20+/m0/s1
InChIKey IEMWQOKNVXLTGS-XCFIXVDISA-N
Literature Reference Author Y.ZHAO,J.X.PU,S.X.HUANG,Y.L.WU,L.B.YANG,W.L.XIAO,Q.B.HAN,G.Q .CHEN,H.D.SUN
Literature Reference Citation J.NAT.PROD.,72,125(2009)
Literature Reference DOI 10.1021/np800484j
Molecular Weight 350.455 g/mol
Sample ID 32060
Solvent C5D5N