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3-O-BETA-LYCOTETRAOSYL_(25S)-YAMOGENIN
SpectraBase Compound ID 2QQHc4JVugv
InChI InChI=1S/C50H80O22/c1-20-7-12-50(64-18-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-45-40(62)37(59)41(31(17-53)68-45)69-47-43(71-46-39(61)36(58)34(56)29(15-51)66-46)42(35(57)30(16-52)67-47)70-44-38(60)33(55)27(54)19-63-44/h5,20-21,23-47,51-62H,6-19H2,1-4H3/t20?,21-,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+/m0/s1
InChIKey XGYNVBAFYOIJRP-RMVDDSRLSA-N
Mol Weight 1033.2 g/mol
Molecular Formula C50H80O22
Exact Mass 1032.514124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HBrq7LRiFmo
Name 3-O-BETA-LYCOTETRAOSYL_(25S)-YAMOGENIN
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H80O22
InChI InChI=1S/C50H80O22/c1-20-7-12-50(64-18-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-45-40(62)37(59)41(31(17-53)68-45)69-47-43(71-46-39(61)36(58)34(56)29(15-51)66-46)42(35(57)30(16-52)67-47)70-44-38(60)33(55)27(54)19-63-44/h5,20-21,23-47,51-62H,6-19H2,1-4H3/t20?,21-,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+/m0/s1
InChIKey XGYNVBAFYOIJRP-RMVDDSRLSA-N
Literature Reference Author B.MA,B.WANG,J.DONG,X.YAN,H.ZHANG,A.TU
Literature Reference Citation PLANTA.MED.,63,376(1997)
Literature Reference DOI 10.1055/s-2006-957710
Molecular Weight 1033.172 g/mol
Solvent C5D5N
Source File Reference UIAP988