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YUNGENSIN_C;2-{[5,7-DIHYDROXY-2-METHYL-2-(4-METHYL-3-PENTENYL)-8-BUTANOYL-6-CHROMENYL]-METHYL}-3,5-DIHYDROXY-4-METHYL-4-(3,7-DIMETHYL-
SpectraBase Compound ID 9E6d5GDlVBP
InChI InChI=1S/C40H52O8/c1-10-13-30(42)32-34(44)28(33(43)27-18-20-39(8,48-36(27)32)19-12-15-24(4)5)22-29-35(45)31(26(7)41)38(47)40(9,37(29)46)21-17-25(6)16-11-14-23(2)3/h14-15,17-18,20,43-44,46-47H,10-13,16,19,21-22H2,1-9H3/b25-17+
InChIKey UKQRDKMWMFEWPI-KOEQRZSOSA-N
Mol Weight 660.8 g/mol
Molecular Formula C40H52O8
Exact Mass 660.366219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID VhpuRNZhmZ
Name YUNGENSIN_C;2-{[5,7-DIHYDROXY-2-METHYL-2-(4-METHYL-3-PENTENYL)-8-BUTANOYL-6-CHROMENYL]-METHYL}-3,5-DIHYDROXY-4-METHYL-4-(3,7-DIMETHYL-
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H52O8
InChI InChI=1S/C40H52O8/c1-10-13-30(42)32-34(44)28(33(43)27-18-20-39(8,48-36(27)32)19-12-15-24(4)5)22-29-35(45)31(26(7)41)38(47)40(9,37(29)46)21-17-25(6)16-11-14-23(2)3/h14-15,17-18,20,43-44,46-47H,10-13,16,19,21-22H2,1-9H3/b25-17+
InChIKey UKQRDKMWMFEWPI-KOEQRZSOSA-N
Literature Reference Author C.SOCOLSKY,M.E.ARENA,Y.ASAKAWA,A.BARDON
Literature Reference Citation J.NAT.PROD.,73,1751(2010)
Literature Reference DOI 10.1021/np1001779
Molecular Weight 660.848 g/mol
Sample ID 36101
Solvent ACETONE-D6