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UNRANOSIDE-A;R-2-O-ACETYL-GLUCOPYRANOSYL-(1->6)-MARTYNOSIDE
SpectraBase Compound ID GH1dH4cwHSp
InChI InChI=1S/C39H52O21/c1-17-28(45)31(48)36(56-18(2)41)39(55-17)60-35-33(50)38(53-12-11-20-6-9-23(51-3)22(43)13-20)58-26(16-54-37-32(49)30(47)29(46)25(15-40)57-37)34(35)59-27(44)10-7-19-5-8-21(42)24(14-19)52-4/h5-10,13-14,17,25-26,28-40,42-43,45-50H,11-12,15-16H2,1-4H3/b10-7+/t17-,25+,26-,28-,29+,30-,31+,32+,33-,34-,35-,36+,37+,38-,39-/m0/s1
InChIKey XQYGNOFIONAZIJ-AMFYCUSJSA-N
Mol Weight 856.8 g/mol
Molecular Formula C39H52O21
Exact Mass 856.300109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMHpLvCntZV
Name UNRANOSIDE-A;R-2-O-ACETYL-GLUCOPYRANOSYL-(1->6)-MARTYNOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H52O21
InChI InChI=1S/C39H52O21/c1-17-28(45)31(48)36(56-18(2)41)39(55-17)60-35-33(50)38(53-12-11-20-6-9-23(51-3)22(43)13-20)58-26(16-54-37-32(49)30(47)29(46)25(15-40)57-37)34(35)59-27(44)10-7-19-5-8-21(42)24(14-19)52-4/h5-10,13-14,17,25-26,28-40,42-43,45-50H,11-12,15-16H2,1-4H3/b10-7+/t17-,25+,26-,28-,29+,30-,31+,32+,33-,34-,35-,36+,37+,38-,39-/m0/s1
InChIKey XQYGNOFIONAZIJ-AMFYCUSJSA-N
Literature Reference Author H.OTSUKA
Literature Reference Citation PHYTOCHEM.,32,979(1993)
Literature Reference DOI 10.1016/0031-9422(93)85239-N
Molecular Weight 856.829 g/mol
Solvent CD3OD
Source File Reference UWLU6278