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XEROPHILUSIN_VII;1-BETA,3-ALPHA,6-BETA,7-BETA,14-BETA-PENTAHYDROXY-19-ACETOXY-7-ALPHA,20-EPOXY-ENT-KAUR-16-EN-15-ONE
SpectraBase Compound ID DktuE5UaVks
InChI InChI=1S/C22H30O9/c1-9-11-4-5-12-20-8-31-22(29,21(12,16(9)26)17(11)27)18(28)15(20)19(3,7-30-10(2)23)13(24)6-14(20)25/h11-15,17-18,24-25,27-29H,1,4-8H2,2-3H3/t11-,12-,13+,14+,15+,17+,18-,19+,20+,21-,22+/m0/s1
InChIKey BKTVHCJQIOTFPT-ZSLLSLKVSA-N
Mol Weight 438.47 g/mol
Molecular Formula C22H30O9
Exact Mass 438.188983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXhr2lstYyF
Name XEROPHILUSIN_VII;1-BETA,3-ALPHA,6-BETA,7-BETA,14-BETA-PENTAHYDROXY-19-ACETOXY-7-ALPHA,20-EPOXY-ENT-KAUR-16-EN-15-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O9
InChI InChI=1S/C22H30O9/c1-9-11-4-5-12-20-8-31-22(29,21(12,16(9)26)17(11)27)18(28)15(20)19(3,7-30-10(2)23)13(24)6-14(20)25/h11-15,17-18,24-25,27-29H,1,4-8H2,2-3H3/t11-,12-,13+,14+,15+,17+,18-,19+,20+,21-,22+/m0/s1
InChIKey BKTVHCJQIOTFPT-ZSLLSLKVSA-N
Literature Reference Author L.M.LI,Z.Y.WENG,S.X.HUANG,J.X.PU,S.H.LI,H.HUANG,B.B.YANG,Y.H AN,W.L.XIAO,M.L.LI,Q
Literature Reference Citation J.NAT.PROD.,70,1295(2007)
Literature Reference DOI 10.1021/np070205m
Molecular Weight 438.475 g/mol
Sample ID 31397
Solvent C5D5N