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5A-ALPHA,6,9,9A-BETA,10-PENTAHYDRO-10-BETA-HYDROXY-7-METHYLANTHRA-[1.2-D]-[1.3]-DIOXAL-5-ONE
SpectraBase Compound ID AUNaV3A9ghw
InChI InChI=1S/C16H16O4/c1-8-2-3-9-11(6-8)14(17)10-4-5-12-16(20-7-19-12)13(10)15(9)18/h2,4-5,9,11,15,18H,3,6-7H2,1H3/t9-,11-,15+/m0/s1
InChIKey IDEZBPJGADQLHU-CCUNJIBTSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KscV8atfRu7
Name 5A-ALPHA,6,9,9A-BETA,10-PENTAHYDRO-10-BETA-HYDROXY-7-METHYLANTHRA-[1.2-D]-[1.3]-DIOXAL-5-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16O4
InChI InChI=1S/C16H16O4/c1-8-2-3-9-11(6-8)14(17)10-4-5-12-16(20-7-19-12)13(10)15(9)18/h2,4-5,9,11,15,18H,3,6-7H2,1H3/t9-,11-,15+/m0/s1
InChIKey IDEZBPJGADQLHU-CCUNJIBTSA-N
Literature Reference Author M.L.ZHANG,D.IRWIN,X.N.LI,F.SAURIOL,X.W.SHI,Y.F.WANG,C.H.HUO, L.G.LI,Y.C.GU,Q.W.SH
Literature Reference Citation J.NAT.PROD.,75,2076(2012)
Literature Reference DOI 10.1021/np300386d
Molecular Weight 272.301 g/mol
Sample ID 41678
Solvent CDCl3