SpectraBase Compound ID | 4arjcDyars7 |
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InChI | InChI=1S/C38H48O20/c1-38(15-26(42)43,58-37-35(32(49)30(47)25(18-40)55-37)56-27(44)11-8-19-6-9-21(51-2)10-7-19)16-28(45)53-12-4-5-20-13-22(41)34(23(14-20)52-3)57-36-33(50)31(48)29(46)24(17-39)54-36/h4-11,13-14,24-25,29-33,35-37,39-41,46-50H,12,15-18H2,1-3H3,(H,42,43)/b5-4+,11-8+/t24-,25+,29-,30+,31+,32-,33-,35+,36+,37-,38?/m0/s1 |
InChIKey | PQBVRHUINJXVQC-UWRWVAICSA-N |
Mol Weight | 824.8 g/mol |
Molecular Formula | C38H48O20 |
Exact Mass | 824.273894 g/mol |
SpectraBase Spectrum ID | LnCAIzQrxUh |
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Name | BARBATOSIDE-B;WAHLENBERGIOSIDE-3'-O-[2'''-(PARA-METHOXYCINNAMOYL)]-GLUCOSIDE |
Compound Number | 6 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C38H48O20 |
InChI | InChI=1S/C38H48O20/c1-38(15-26(42)43,58-37-35(32(49)30(47)25(18-40)55-37)56-27(44)11-8-19-6-9-21(51-2)10-7-19)16-28(45)53-12-4-5-20-13-22(41)34(23(14-20)52-3)57-36-33(50)31(48)29(46)24(17-39)54-36/h4-11,13-14,24-25,29-33,35-37,39-41,46-50H,12,15-18H2,1-3H3,(H,42,43)/b5-4+,11-8+/t24-,25+,29-,30+,31+,32-,33-,35+,36+,37-,38?/m0/s1 |
InChIKey | PQBVRHUINJXVQC-UWRWVAICSA-N |
Literature Reference Author | M.CUENDET,O.POTTERAT,K.HOSTETTMANN |
Literature Reference Citation | PHYTOCHEM.,56,631(2001) |
Literature Reference DOI | 10.1016/S0031-9422(00)00423-4 |
Molecular Weight | 824.787 g/mol |
Solvent | CD3OD |
Source File Reference | UWVN2007 |