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TRIUMBELLIN

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TRIUMBELLIN
SpectraBase Compound ID J4eketqzR9H
InChI InChI=1S/C33H24O13/c1-14-27(37)28(38)29(39)33(41-14)44-20-9-4-17-12-22(42-18-7-2-15-5-10-23(35)43-21(15)13-18)32(40)46-31(17)26(20)25-19(34)8-3-16-6-11-24(36)45-30(16)25/h2-14,27-29,33-34,37-39H,1H3/t14-,27-,28+,29+,33-/m1/s1
InChIKey OHRCJYHQDRFPOM-QSWFPLBKSA-N
Mol Weight 628.5 g/mol
Molecular Formula C33H24O13
Exact Mass 628.121691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ny4i1pIBYh
Name TRIUMBELLIN;7-O-(ALPHA-L-RHAMNOPYRANOSYL)-3-[(2-O-OXO-2H-1-BENZOPYRAN-7-YL)-OXY]-8-(2-OXO-2H-1-BENZOPYRAN-8-YL)-2H-1-BENZOPYRAN-2-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H24O13
InChI InChI=1S/C33H24O13/c1-14-27(37)28(38)29(39)33(41-14)44-20-9-4-17-12-22(42-18-7-2-15-5-10-23(35)43-21(15)13-18)32(40)46-31(17)26(20)25-19(34)8-3-16-6-11-24(36)45-30(16)25/h2-14,27-29,33-34,37-39H,1H3/t14-,27-,28+,29+,33-/m1/s1
InChIKey OHRCJYHQDRFPOM-QSWFPLBKSA-N
Literature Reference Author B.KREHER,A.NESZMELYI,H.WAGNER
Literature Reference Citation PHYTOCHEM.,29,3633(1990)
Literature Reference DOI 10.1016/0031-9422(90)85290-V
Molecular Weight 628.546 g/mol
Solvent CDCl3:DMSO-D6=1:1
Source File Reference UWLU26924