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#4;CANTALASAPONIN-I-B4;(23S,25R)-5-ALPHA-SPIROST-3-BETA,6-ALPHA,23-TRIOL-3-O-BETA-D-GLUCOPYRANOSYL-6-O-[ALPHA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-D-GLUCOPYRANOSYL-(1

Compound with spectra: 1 NMR

#4;CANTALASAPONIN-I-B4;(23S,25R)-5-ALPHA-SPIROST-3-BETA,6-ALPHA,23-TRIOL-3-O-BETA-D-GLUCOPYRANOSYL-6-O-[ALPHA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-D-GLUCOPYRANOSYL-(1
SpectraBase Compound ID BR427vjK0by
InChI InChI=1S/C51H84O25/c1-18-9-31(56)51(67-17-18)19(2)32-26(76-51)12-23-21-11-25(24-10-20(5-7-49(24,3)22(21)6-8-50(23,32)4)68-45-39(63)35(59)33(57)27(13-52)70-45)69-46-41(65)37(61)43(29(15-54)72-46)75-48-42(66)38(62)44(30(16-55)73-48)74-47-40(64)36(60)34(58)28(14-53)71-47/h18-48,52-66H,5-17H2,1-4H3/t18-,19+,20+,21-,22+,23+,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+/m1/s1
InChIKey ZTRXMIONZASHDG-BRSKIDQNSA-N
Mol Weight 1097.2 g/mol
Molecular Formula C51H84O25
Exact Mass 1096.530168 g/mol
Enantiomer InChIKey ZTRXMIONZASHDG-UXIFXWDNSA-N

View Spectrum of #4;CANTALASAPONIN-I-B4;(23S,25R)-5-ALPHA-SPIROST-3-BETA,6-ALPHA,23-TRIOL-3-O-BETA-D-GLUCOPYRANOSYL-6-O-[ALPHA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-D-GLUCOPYRANOSYL-(1

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Structure elucidation and complete NMR spectral assignments of glucosylated saponins of cantalasaponin I Magnetic Resonance in Chemistry 2012
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