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YUNGENSIN_E;2-{[2,4,6-TRIHYDROXY-5-(3,7-DIMETHYL-2,6-OCTADIENYL)-3-BUTANOYLPHENYL]-METHYL}-3,5-DIHYDROXY-4-METHYL-4-(3,7-DIMETHYL-2,6-
SpectraBase Compound ID 20aQKSsVcnH
InChI InChI=1S/C40H54O8/c1-10-13-31(42)33-35(44)28(19-18-25(6)16-11-14-23(2)3)34(43)29(36(33)45)22-30-37(46)32(27(8)41)39(48)40(9,38(30)47)21-20-26(7)17-12-15-24(4)5/h14-15,18,20,43-45,47-48H,10-13,16-17,19,21-22H2,1-9H3/b25-18+,26-20+
InChIKey YSQMAFQGVXTTLL-ICRKYIHISA-N
Mol Weight 662.9 g/mol
Molecular Formula C40H54O8
Exact Mass 662.381869 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 76AtpCURLAg
Name YUNGENSIN_E;2-{[2,4,6-TRIHYDROXY-5-(3,7-DIMETHYL-2,6-OCTADIENYL)-3-BUTANOYLPHENYL]-METHYL}-3,5-DIHYDROXY-4-METHYL-4-(3,7-DIMETHYL-2,6-
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H54O8
InChI InChI=1S/C40H54O8/c1-10-13-31(42)33-35(44)28(19-18-25(6)16-11-14-23(2)3)34(43)29(36(33)45)22-30-37(46)32(27(8)41)39(48)40(9,38(30)47)21-20-26(7)17-12-15-24(4)5/h14-15,18,20,43-45,47-48H,10-13,16-17,19,21-22H2,1-9H3/b25-18+,26-20+
InChIKey YSQMAFQGVXTTLL-ICRKYIHISA-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 662.864 g/mol
Sample ID 36103
Solvent ACETONE-D6