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PIPERADUNCIN-A;METHYL-3-(1-[2,4-DIHYDROXY-6-METHOXY-3-(3-PHENYLPROPANOYL)-PHENYL]-3-METHYL-2-BUTENYL)-4-HYDROXYBENZOATE
SpectraBase Compound ID LGb8D28BR7D
InChI InChI=1S/C29H30O7/c1-17(2)14-21(20-15-19(29(34)36-4)11-13-22(20)30)26-25(35-3)16-24(32)27(28(26)33)23(31)12-10-18-8-6-5-7-9-18/h5-9,11,13-16,21,30,32-33H,10,12H2,1-4H3
InChIKey UWDJCYWVPNETPR-UHFFFAOYSA-N
Mol Weight 490.55 g/mol
Molecular Formula C29H30O7
Exact Mass 490.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dn8qQqMSHno
Name PIPERADUNCIN-A;METHYL-3-(1-[2,4-DIHYDROXY-6-METHOXY-3-(3-PHENYLPROPANOYL)-PHENYL]-3-METHYL-2-BUTENYL)-4-HYDROXYBENZOATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H30O7
InChI InChI=1S/C29H30O7/c1-17(2)14-21(20-15-19(29(34)36-4)11-13-22(20)30)26-25(35-3)16-24(32)27(28(26)33)23(31)12-10-18-8-6-5-7-9-18/h5-9,11,13-16,21,30,32-33H,10,12H2,1-4H3
InChIKey UWDJCYWVPNETPR-UHFFFAOYSA-N
Literature Reference Author J.ORJALA,A.D.WRIGHT,H.BEHRENDS,G.FOLKERS,O.STICHER,H.RUEGGER ,T.RALI
Literature Reference Citation J.NAT.PROD.,57,18(1994)
Literature Reference DOI 10.1021/np50103a003
Molecular Weight 490.553 g/mol
Solvent CDCl3
Source File Reference UWCS17795