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PERACETYLATED-AXIDJIFEROSIDE-A;MAJOR-COMPONENT
SpectraBase Compound ID 5vslZOPAVxU
InChI InChI=1S/C62H107NO17/c1-10-12-14-16-18-20-22-24-25-26-27-28-29-30-31-33-35-37-39-41-43-55(75-48(5)66)61(71)63-53(57(76-49(6)67)54(74-47(4)65)42-40-38-36-34-32-23-21-19-17-15-13-11-2)44-73-62-60(79-52(9)70)59(78-51(8)69)58(77-50(7)68)56(80-62)45-72-46(3)64/h38,40,53-60,62H,10-37,39,41-45H2,1-9H3,(H,63,71)/b40-38+/t53-,54+,55+,56-,57-,58+,59+,60-,62-/m0/s1
InChIKey FCOUFFXOBNTRGC-LLUNWEGVSA-N
Mol Weight 1138.5 g/mol
Molecular Formula C62H107NO17
Exact Mass 1137.753901 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CL5K7Lso4kr
Name PERACETYLATED-AXIDJIFEROSIDE-A;MAJOR-COMPONENT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H107NO17
InChI InChI=1S/C62H107NO17/c1-10-12-14-16-18-20-22-24-25-26-27-28-29-30-31-33-35-37-39-41-43-55(75-48(5)66)61(71)63-53(57(76-49(6)67)54(74-47(4)65)42-40-38-36-34-32-23-21-19-17-15-13-11-2)44-73-62-60(79-52(9)70)59(78-51(8)69)58(77-50(7)68)56(80-62)45-72-46(3)64/h38,40,53-60,62H,10-37,39,41-45H2,1-9H3,(H,63,71)/b40-38+/t53-,54+,55+,56-,57-,58+,59+,60-,62-/m0/s1
InChIKey FCOUFFXOBNTRGC-LLUNWEGVSA-N
Literature Reference Author F.FAROKHI,P.GRELLIER,M.CLEMENT,C.ROUSSAKIS,P.M.LOISEAU,E.GEN IN-SEWARD,J.M.KORNPR
Literature Reference Citation MAR.DRUGS,11,1304(2013)
Literature Reference DOI 10.3390/md11041304
Molecular Weight 1138.528 g/mol
Source File Reference UWLU74818