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ANGUSTANOIC_ACID-D
SpectraBase Compound ID AmBT1Y7inCt
InChI InChI=1S/C20H30O5/c1-16(2,23)19-10-11-20(25-24-19)13(12-19)6-7-14-17(3,15(21)22)8-5-9-18(14,20)4/h12,14,23H,5-11H2,1-4H3,(H,21,22)/t14-,17-,18-,19-,20+/m0/s1
InChIKey FPDDUPUDFYVZHW-QOOKETHRSA-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 BtOXgANBlTO
Name ANGUSTANOIC_ACID-D
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-16(2,23)19-10-11-20(25-24-19)13(12-19)6-7-14-17(3,15(21)22)8-5-9-18(14,20)4/h12,14,23H,5-11H2,1-4H3,(H,21,22)/t14-,17-,18-,19-,20+/m0/s1
InChIKey FPDDUPUDFYVZHW-QOOKETHRSA-N
Literature Reference Author L.K.SY,G.D.BROWN
Literature Reference Citation J.NAT.PROD.,61,907(1998)
Literature Reference DOI 10.1021/np980054a
Molecular Weight 350.455 g/mol
Solvent CDCl3
Source File Reference UWMK109