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DUNNIANA-ACID-A;3,4-SECO-2(4)-CLERODEN-3,15-DIOIC-ACID
SpectraBase Compound ID CogGqh0xrvR
InChI InChI=1S/C20H32O4/c1-12(10-17(21)22)6-8-19(4)13(2)7-9-20(5)14(3)15(18(23)24)11-16(19)20/h12-13,16H,6-11H2,1-5H3,(H,21,22)(H,23,24)/t12?,13-,16-,19+,20+/m1/s1
InChIKey BXKYVIXFZNEZFP-JZQROIDNSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8y7J5p2Efqr
Name DUNNIANA-ACID-A;3,4-SECO-2(4)-CLERODEN-3,15-DIOIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-12(10-17(21)22)6-8-19(4)13(2)7-9-20(5)14(3)15(18(23)24)11-16(19)20/h12-13,16H,6-11H2,1-5H3,(H,21,22)(H,23,24)/t12?,13-,16-,19+,20+/m1/s1
InChIKey BXKYVIXFZNEZFP-JZQROIDNSA-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 336.472 g/mol
Solvent CDCl3
Source File Reference UWSI4094