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KOELZIOSIDE;6-O-(2'',3''-DI-O-TRANS-CINNAMOYL-4''-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYL-CATALPOL
SpectraBase Compound ID KOPya36fn7H
InChI InChI=1S/C41H46O17/c1-21-33(52-22(2)44)35(54-27(45)15-13-23-9-5-3-6-10-23)36(55-28(46)16-14-24-11-7-4-8-12-24)40(51-21)56-34-25-17-18-50-38(29(25)41(20-43)37(34)58-41)57-39-32(49)31(48)30(47)26(19-42)53-39/h3-18,21,25-26,29-40,42-43,47-49H,19-20H2,1-2H3/b15-13+,16-14+/t21-,25-,26+,29-,30+,31-,32+,33-,34+,35+,36+,37+,38+,39-,40-,41-/m1/s1
InChIKey NKORFEGGMJANHB-RQIBNMHHSA-N
Mol Weight 810.8 g/mol
Molecular Formula C41H46O17
Exact Mass 810.2735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dt1Iqm1cyUh
Name KOELZIOSIDE;6-O-(2'',3''-DI-O-TRANS-CINNAMOYL-4''-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYL-CATALPOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H46O17
InChI InChI=1S/C41H46O17/c1-21-33(52-22(2)44)35(54-27(45)15-13-23-9-5-3-6-10-23)36(55-28(46)16-14-24-11-7-4-8-12-24)40(51-21)56-34-25-17-18-50-38(29(25)41(20-43)37(34)58-41)57-39-32(49)31(48)30(47)26(19-42)53-39/h3-18,21,25-26,29-40,42-43,47-49H,19-20H2,1-2H3/b15-13+,16-14+/t21-,25-,26+,29-,30+,31-,32+,33-,34+,35+,36+,37+,38+,39-,40-,41-/m1/s1
InChIKey NKORFEGGMJANHB-RQIBNMHHSA-N
Literature Reference Author S.P.S.BHANDARI,A.MISHRA,R.ROY,H.S.GARG
Literature Reference Citation PHYTOCHEM.,31,689(1992)
Literature Reference DOI 10.1016/0031-9422(92)90061-T
Molecular Weight 810.806 g/mol
Solvent CD3OD
Source File Reference UWLU6181