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26-O-BETA-D-GLUCOPYRANOSYL-(25-R)-FUROST-5-EN-3-BETA,22-XI-DIOL_3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPY
SpectraBase Compound ID 3qcktTyBS44
InChI InChI=1S/C51H84O23/c1-20(19-66-45-39(61)37(59)34(56)29(16-52)69-45)8-13-51(65)21(2)32-28(74-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)68-48-44(73-46-40(62)36(58)33(55)22(3)67-46)42(64)43(31(18-54)71-48)72-47-41(63)38(60)35(57)30(17-53)70-47/h6,20-22,24-48,52-65H,7-19H2,1-5H3/t20-,21+,22+,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 RPYHJEFMMXMMHG-JLLMHHHTSA-N
Mol Weight 1065.2 g/mol
Molecular Formula C51H84O23
Exact Mass 1064.540339 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Mc9xGZrzpt
Name 26-O-BETA-D-GLUCOPYRANOSYL-(25-R)-FUROST-5-EN-3-BETA,22-XI-DIOL_3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->4)]-BETA-D-GLUCOPY
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H84O23
InChI InChI=1S/C51H84O23/c1-20(19-66-45-39(61)37(59)34(56)29(16-52)69-45)8-13-51(65)21(2)32-28(74-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)68-48-44(73-46-40(62)36(58)33(55)22(3)67-46)42(64)43(31(18-54)71-48)72-47-41(63)38(60)35(57)30(17-53)70-47/h6,20-22,24-48,52-65H,7-19H2,1-5H3/t20-,21+,22+,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 RPYHJEFMMXMMHG-JLLMHHHTSA-N
Literature Reference Author K.ORI,Y.MIMAKI,K.MITO,Y.SASHIDA,T.NIKAIDO,T.OHMOTO,A.MASUKO
Literature Reference Citation PHYTOCHEM.,31,2767(1992)
Literature Reference DOI 10.1016/0031-9422(92)83627-B
Molecular Weight 1065.214 g/mol
Solvent C5D5N
Source File Reference UWMZ23188