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PABULARIN-B

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PABULARIN-B
SpectraBase Compound ID KX6ykoP0lqz
InChI InChI=1S/C28H30O13/c1-13-24(16(30)7-9-35-13)40-27-26(23(34)22(33)19(11-29)39-27)41-28(2,3)20(31)12-37-25-14-4-5-21(32)38-18(14)10-17-15(25)6-8-36-17/h4-10,19-20,22-23,26-27,29,31,33-34H,11-12H2,1-3H3/t19-,20?,22-,23+,26-,27+/m1/s1
InChIKey BDLJCFOGDWQORY-CLASKDJUSA-N
Mol Weight 574.54 g/mol
Molecular Formula C28H30O13
Exact Mass 574.168641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Akl3RyxMpoi
Name PABULARIN-B
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H30O13
InChI InChI=1S/C28H30O13/c1-13-24(16(30)7-9-35-13)40-27-26(23(34)22(33)19(11-29)39-27)41-28(2,3)20(31)12-37-25-14-4-5-21(32)38-18(14)10-17-15(25)6-8-36-17/h4-10,19-20,22-23,26-27,29,31,33-34H,11-12H2,1-3H3/t19-,20?,22-,23+,26-,27+/m1/s1
InChIKey BDLJCFOGDWQORY-CLASKDJUSA-N
Literature Reference Author Y.TADA,Y.SHIKISHIMA,Y.TAKAISHI,H.SHIBATA,T.HIGUTI,G.HONDA,M. ITO,Y.TAKEDA,O.K.KOD
Literature Reference Citation PHYTOCHEM.,59,649(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00023-7
Molecular Weight 574.538 g/mol
Solvent Unknown
Source File Reference UWVN2768