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LOPHIROSIDE-A1-PENTAACETATE

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LOPHIROSIDE-A1-PENTAACETATE
SpectraBase Compound ID DLc1qNhqvH7
InChI InChI=1S/C38H39NO16/c1-20(40)47-19-30-33(49-22(3)42)34(50-23(4)43)35(51-24(5)44)38(54-30)53-28-18-29(52-36(45)25-12-8-6-9-13-25)32(31(48-21(2)41)27(28)16-17-39)55-37(46)26-14-10-7-11-15-26/h6-16,28-35,38H,18-19H2,1-5H3/b27-16+/t28?,29-,30-,31-,32-,33-,34+,35-,38-/m0/s1
InChIKey DUDHBBVXPSMVPL-ROXBAKACSA-N
Mol Weight 765.7 g/mol
Molecular Formula C38H39NO16
Exact Mass 765.226884 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6DkM8qqB98s
Name LOPHIROSIDE-A1-PENTAACETATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H39NO16
InChI InChI=1S/C38H39NO16/c1-20(40)47-19-30-33(49-22(3)42)34(50-23(4)43)35(51-24(5)44)38(54-30)53-28-18-29(52-36(45)25-12-8-6-9-13-25)32(31(48-21(2)41)27(28)16-17-39)55-37(46)26-14-10-7-11-15-26/h6-16,28-35,38H,18-19H2,1-5H3/b27-16+/t28?,29-,30-,31-,32-,33-,34+,35-,38-/m0/s1
InChIKey DUDHBBVXPSMVPL-ROXBAKACSA-N
Literature Reference Author A.MURAKAMI,H.OHIGASHI,S.TANAKA,M.HIROTA,R.IRIE,N.TAKEDA,A.TA TEMATSU,K.KOSHIMIZU
Literature Reference Citation PHYTOCHEM.,32,1461(1993)
Literature Reference DOI 10.1016/0031-9422(93)85160-S
Molecular Weight 765.725 g/mol
Solvent ACETONE-D6
Source File Reference UWLU6549