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DUNNIANA-ACID-B;3,4-SECO-3-OXO-2(4)-CLERODEN-15-OIC-ACID
SpectraBase Compound ID 1XKB2k2bGcY
InChI InChI=1S/C20H32O3/c1-13(10-18(22)23)6-8-19(4)14(2)7-9-20(5)15(3)16(12-21)11-17(19)20/h12-14,17H,6-11H2,1-5H3,(H,22,23)/t13?,14-,17-,19+,20+/m1/s1
InChIKey OACSWPFHEOKUGW-JNSXJZLISA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IpVn4JtDipR
Name DUNNIANA-ACID-B;3,4-SECO-3-OXO-2(4)-CLERODEN-15-OIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-13(10-18(22)23)6-8-19(4)14(2)7-9-20(5)15(3)16(12-21)11-17(19)20/h12-14,17H,6-11H2,1-5H3,(H,22,23)/t13?,14-,17-,19+,20+/m1/s1
InChIKey OACSWPFHEOKUGW-JNSXJZLISA-N
Literature Reference Author H.P.HE,Y.M.SHEN,X.HONG,Y.B.ZHAO,J.ZHOU,X.J.HAO
Literature Reference Citation J.NAT.PROD.,65,392(2002)
Literature Reference DOI 10.1021/np0103517
Molecular Weight 320.472 g/mol
Solvent CDCl3
Source File Reference UWSI4095