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VIBRUTINOSIDE-III
SpectraBase Compound ID KZFTR76M3Eo
InChI InChI=1S/C32H42O15/c1-16(2)10-25(38)47-30-26-21(11-23(36)32(26,41)15-44-17(3)34)19(13-42-30)14-43-31-29(28(40)27(39)22(12-33)45-31)46-24(37)9-6-18-4-7-20(35)8-5-18/h4-9,13,16,21-23,26-31,33,35-36,39-41H,10-12,14-15H2,1-3H3/b9-6-/t21?,22-,23-,26?,27-,28+,29-,30-,31-,32+/m0/s1
InChIKey AAALJWLFINEDCQ-MKFCKTENSA-N
Mol Weight 666.7 g/mol
Molecular Formula C32H42O15
Exact Mass 666.252371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mz0BGHt6tm
Name VIBRUTINOSIDE-III
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H42O15
InChI InChI=1S/C32H42O15/c1-16(2)10-25(38)47-30-26-21(11-23(36)32(26,41)15-44-17(3)34)19(13-42-30)14-43-31-29(28(40)27(39)22(12-33)45-31)46-24(37)9-6-18-4-7-20(35)8-5-18/h4-9,13,16,21-23,26-31,33,35-36,39-41H,10-12,14-15H2,1-3H3/b9-6-/t21?,22-,23-,26?,27-,28+,29-,30-,31-,32+/m0/s1
InChIKey AAALJWLFINEDCQ-MKFCKTENSA-N
Literature Reference Author L.TOMASSINI,M.F.COMETA,S.FODDAI,M.NICOLETTI
Literature Reference Citation PHYTOCHEM.,38,423(1995)
Literature Reference DOI 10.1016/0031-9422(94)00618-4
Molecular Weight 666.676 g/mol
Solvent CD3OD
Source File Reference UWMS4742