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NEOSIBIRICOSIDE_B;(25-S)-1-O-ACETYLSPIROST-5-ENE-1-BETA,3-BETA-DIOL_3-O-BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCOPYRANO
SpectraBase Compound ID 2doSH8zIrMH
InChI InChI=1S/C52H82O24/c1-20-8-11-52(67-18-20)21(2)34-29(76-52)14-27-25-7-6-23-12-24(13-33(68-22(3)56)51(23,5)26(25)9-10-50(27,34)4)69-47-42(65)39(62)43(32(17-55)72-47)73-49-45(75-48-41(64)38(61)36(59)30(15-53)70-48)44(37(60)31(16-54)71-49)74-46-40(63)35(58)28(57)19-66-46/h6,20-21,24-49,53-55,57-65H,7-19H2,1-5H3/t20-,21+,24-,25-,26+,27+,28-,29+,30+,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41+,42-,43+,44-,45+,46+,47-,48-,49-,50+,51+,52+/m1/s1
InChIKey NNFPCHSMSQYLNS-NIECXZHDSA-N
Mol Weight 1091.2 g/mol
Molecular Formula C52H82O24
Exact Mass 1090.519603 g/mol
Enantiomer InChIKey NNFPCHSMSQYLNS-KDBFBHIISA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Steroidal Saponins from the Rhizomes of Polygonatum sibiricum Journal of Natural Products 2006
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