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TRAGOPOGONOSIDE-H-METHYLESTER
SpectraBase Compound ID 9cWg8drQ6lr
InChI InChI=1S/C58H84O22/c1-53(2)20-21-58(52(71)80-50-46(39(64)31(61)26-74-50)77-38(63)15-11-27-10-13-30(60)32(22-27)72-8)29(23-53)28-12-14-35-55(5)18-17-37(54(3,4)34(55)16-19-56(35,6)57(28,7)24-36(58)62)76-51-47(43(68)42(67)45(78-51)48(70)73-9)79-49-44(69)41(66)40(65)33(25-59)75-49/h10-13,15,22,29,31,33-37,39-47,49-51,59-62,64-69H,14,16-21,23-26H2,1-9H3/b15-11+/t29-,31+,33+,34?,35?,36+,37-,39-,40-,41-,42-,43-,44+,45-,46+,47+,49-,50-,51+,55?,56?,57?,58+/m0/s1
InChIKey JJKQRNTVXYJWHQ-QGTONHFDSA-N
Mol Weight 1133.3 g/mol
Molecular Formula C58H84O22
Exact Mass 1132.545424 g/mol
Enantiomer InChIKey JJKQRNTVXYJWHQ-HJCICNMJSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Tragopogonosides A-I, oleanane saponins from Tragopogon pratensis Phytochemistry 1992

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