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PISCROSIDE-B;6'-O-(E)-CINNAMOYL-3-BETA-METHOXY-3,4-DIHYDROCATALPOL
SpectraBase Compound ID ISAr3JDNj9S
InChI InChI=1S/C25H32O12/c1-32-16-9-13-17(25(11-26)22(37-25)18(13)28)23(35-16)36-24-21(31)20(30)19(29)14(34-24)10-33-15(27)8-7-12-5-3-2-4-6-12/h2-8,13-14,16-24,26,28-31H,9-11H2,1H3/b8-7+/t13-,14+,16+,17-,18+,19+,20-,21+,22+,23+,24-,25-/m1/s1
InChIKey LJINOWWMMBQLLM-ZLWYKYGDSA-N
Mol Weight 524.5 g/mol
Molecular Formula C25H32O12
Exact Mass 524.189376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CTo1r72ttYU
Name PISCROSIDE-B;6'-O-(E)-CINNAMOYL-3-BETA-METHOXY-3,4-DIHYDROCATALPOL
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H32O12
InChI InChI=1S/C25H32O12/c1-32-16-9-13-17(25(11-26)22(37-25)18(13)28)23(35-16)36-24-21(31)20(30)19(29)14(34-24)10-33-15(27)8-7-12-5-3-2-4-6-12/h2-8,13-14,16-24,26,28-31H,9-11H2,1H3/b8-7+/t13-,14+,16+,17-,18+,19+,20-,21+,22+,23+,24-,25-/m1/s1
InChIKey LJINOWWMMBQLLM-ZLWYKYGDSA-N
Literature Reference Author H.WANG,F.H.WU,F.XIONG,J.J.WU,L.Y.ZHANG,W.C.YE,P.LI,S.X.ZHAO
Literature Reference Citation CHEM.PHARM.BULL.,54,1144(2006)
Literature Reference DOI 10.1248/cpb.54.1144
Molecular Weight 524.522 g/mol
Sample ID 36955
Solvent CD3OD