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#2;NIGELLOSIDE-B;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-GIPSOGENIN-28-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLU

Compound with spectra: 1 NMR

#2;NIGELLOSIDE-B;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-GIPSOGENIN-28-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLU
SpectraBase Compound ID 1Z2zoWp9CTz
InChI InChI=1S/C59H94O27/c1-24-34(64)46(84-49-43(73)40(70)37(67)29(20-61)81-49)45(75)51(79-24)85-47-35(65)27(63)21-77-52(47)83-33-11-12-55(4)31(56(33,5)23-62)10-13-58(7)32(55)9-8-25-26-18-54(2,3)14-16-59(26,17-15-57(25,58)6)53(76)86-50-44(74)41(71)38(68)30(82-50)22-78-48-42(72)39(69)36(66)28(19-60)80-48/h8,23-24,26-52,60-61,63-75H,9-22H2,1-7H3/t24-,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-,55-,56-,57+,58+,59-/m0/s1
InChIKey KRDPVQAMMPYQFZ-UGZFTLGKSA-N
Mol Weight 1235.4 g/mol
Molecular Formula C59H94O27
Exact Mass 1234.598248 g/mol
Enantiomer InChIKey KRDPVQAMMPYQFZ-LPWRUQKXSA-N

View Spectrum of #2;NIGELLOSIDE-B;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-GIPSOGENIN-28-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLU

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
Four New Triterpene Glycosides from Nigella damascena Chemical and Pharmaceutical Bulletin 2007

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