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3,4-Dihydroxyclerodan-13-E-en-15-oic_acid
SpectraBase Compound ID FpMRdODRnjQ
InChI InChI=1S/C20H34O4/c1-13(12-17(22)23)8-10-18(3)14(2)9-11-19(4)15(18)6-7-16(21)20(19,5)24/h12,14-16,21,24H,6-11H2,1-5H3,(H,22,23)/b13-12+/t14-,15+,16+,18-,19-,20-/m1/s1
InChIKey JWWWAEIMVGEDRK-NLZYYNFASA-N
Mol Weight 338.5 g/mol
Molecular Formula C20H34O4
Exact Mass 338.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kt8Og2HoWyV
Name 3,4-DIHYDROXYCLERODAN-13-E-EN-15-OIC_ACID
Compound Number 4
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O4
InChI InChI=1S/C20H34O4/c1-13(12-17(22)23)8-10-18(3)14(2)9-11-19(4)15(18)6-7-16(21)20(19,5)24/h12,14-16,21,24H,6-11H2,1-5H3,(H,22,23)/b13-12+/t14-,15+,16+,18-,19-,20-/m1/s1
InChIKey JWWWAEIMVGEDRK-NLZYYNFASA-N
Literature Reference Author A.L.CAVIN,A.E.HAY,A.MARSTON,H.STOECKLI-EVANS,R.SCOPELLITI,D. DIALLO,K.HOSTETTMANN
Literature Reference Citation J.NAT.PROD.,69,768(2006)
Literature Reference DOI 10.1021/np058123q
Molecular Weight 338.488 g/mol
Solvent CD3OD
Source File Reference UWMZ18351