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ISOSCUTELLAREIN-4'-METHYLETHER-8-O-BETA-D-GLUCURONIDE-6''-N-BUTYLESTER
SpectraBase Compound ID HlyIlipmqEk
InChI InChI=1S/C26H28O12/c1-3-4-9-35-25(33)24-20(31)19(30)21(32)26(38-24)37-22-16(29)10-14(27)18-15(28)11-17(36-23(18)22)12-5-7-13(34-2)8-6-12/h5-8,10-11,19-21,24,26-27,29-32H,3-4,9H2,1-2H3/t19-,20-,21+,24-,26+/m1/s1
InChIKey NSUHKBNUFZSKRR-KMSAWUHLSA-N
Mol Weight 532.5 g/mol
Molecular Formula C26H28O12
Exact Mass 532.158076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5GuNamuPGIh
Name ISOSCUTELLAREIN-4'-METHYLETHER-8-O-BETA-D-GLUCURONIDE-6''-N-BUTYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28O12
InChI InChI=1S/C26H28O12/c1-3-4-9-35-25(33)24-20(31)19(30)21(32)26(38-24)37-22-16(29)10-14(27)18-15(28)11-17(36-23(18)22)12-5-7-13(34-2)8-6-12/h5-8,10-11,19-21,24,26-27,29-32H,3-4,9H2,1-2H3/t19-,20-,21+,24-,26+/m1/s1
InChIKey NSUHKBNUFZSKRR-KMSAWUHLSA-N
Literature Reference Author K.KAMIYA,Y.SAIKI,T.HAMA,Y.FUJIMOTO,H.ENDANG,M.UMAR,T.SATAKE
Literature Reference Citation PHYTOCHEM.,57,297(2001)
Literature Reference DOI 10.1016/S0031-9422(01)00005-X
Molecular Weight 532.501 g/mol
Solvent DMSO-D6
Source File Reference UWVN2190