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CALODIMER_C;6,7-DEAHYDROABIETA-8,11-13-TRIEN-12-YL_7-ALPHA,12-DIHYDROXYABIETA-8,11-13-TRIEN-6-ALPHA-YL_ETHER
SpectraBase Compound ID DaSTyz6RfPh
InChI InChI=1S/C40H56O3/c1-23(2)26-20-28-30(21-31(26)41)40(10)18-12-16-38(7,8)36(40)35(34(28)42)43-32-22-29-25(19-27(32)24(3)4)13-14-33-37(5,6)15-11-17-39(29,33)9/h13-14,19-24,33-36,41-42H,11-12,15-18H2,1-10H3/t33-,34-,35-,36-,39+,40+/m0/s1
InChIKey BVXJJUVTDVHJFN-WYQIBVNASA-N
Mol Weight 584.9 g/mol
Molecular Formula C40H56O3
Exact Mass 584.422946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 28cudVAkEh0
Name CALODIMER_C;6,7-DEAHYDROABIETA-8,11-13-TRIEN-12-YL_7-ALPHA,12-DIHYDROXYABIETA-8,11-13-TRIEN-6-ALPHA-YL_ETHER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H56O3
InChI InChI=1S/C40H56O3/c1-23(2)26-20-28-30(21-31(26)41)40(10)18-12-16-38(7,8)36(40)35(34(28)42)43-32-22-29-25(19-27(32)24(3)4)13-14-33-37(5,6)15-11-17-39(29,33)9/h13-14,19-24,33-36,41-42H,11-12,15-18H2,1-10H3/t33-,34-,35-,36-,39+,40+/m0/s1
InChIKey BVXJJUVTDVHJFN-WYQIBVNASA-N
Literature Reference Author C.L.HSIEH,L.L.SHIU,M.H.TSENG,Y.Y.SHAO,Y.H.KUO
Literature Reference Citation J.NAT.PROD.,69,665(2006)
Literature Reference DOI 10.1021/np058090e
Molecular Weight 584.883 g/mol
Solvent CDCl3
Source File Reference UWMZ18287