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11,12-DIHYDROXYABIETA-8,11,13-TRIEN-18-OIC-ACID
SpectraBase Compound ID GEHcgNge8oS
InChI InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,15(12)17(22)16(13)21)8-5-9-20(14,4)18(23)24/h10-11,14,21-22H,5-9H2,1-4H3,(H,23,24)/t14-,19+,20-/m1/s1
InChIKey QOCOQHXHEBGZNB-VOBQZIQPSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Gs3bMcoMUT
Name 11,12-DIHYDROXYABIETA-8,11,13-TRIEN-18-OIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,15(12)17(22)16(13)21)8-5-9-20(14,4)18(23)24/h10-11,14,21-22H,5-9H2,1-4H3,(H,23,24)/t14-,19+,20-/m1/s1
InChIKey QOCOQHXHEBGZNB-VOBQZIQPSA-N
Literature Reference Author B.GIGANTE,C.SANTOS,A.M.SILVA,M.J.M.CURTO,M.S.J.NASCIMENTO,E. PINTO,M.PEDRO,F.CERQ
Literature Reference Citation BIOORG.MED.CHEM.,11,1631(2003)
Literature Reference DOI 10.1016/S0968-0896(03)00063-4
Molecular Weight 332.440 g/mol
Sample ID 29094
Solvent CDCl3