![GLOMERATOSE-B;3-O-(E)-SINAPOYL-BETA-D-FRUCTOFURANOSYL-(2->1)-[6-O-(E)-PARA-COUMAROYL]-ALPHA-D-GLUCOPYRANOSIDE](/api/spectrum/82BXploRpZg/structure.png?h=300&w=458 "GLOMERATOSE-B;3-O-(E)-SINAPOYL-BETA-D-FRUCTOFURANOSYL-(2->1)-[6-O-(E)-PARA-COUMAROYL]-ALPHA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 3gmzY7kM18y |
|---|---|
| InChI | InChI=1S/C32H38O17/c1-43-19-11-17(12-20(44-2)25(19)38)6-10-24(37)47-30-27(40)21(13-33)48-32(30,15-34)49-31-29(42)28(41)26(39)22(46-31)14-45-23(36)9-5-16-3-7-18(35)8-4-16/h3-12,21-22,26-31,33-35,38-42H,13-15H2,1-2H3/b9-5+,10-6+/t21-,22+,26+,27-,28-,29+,30+,31+,32+/m1/s1 |
| InChIKey | WAVHAANZAIZEDN-DIUCFGAGSA-N |
| Mol Weight | 694.6 g/mol |
| Molecular Formula | C32H38O17 |
| Exact Mass | 694.2109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82BXploRpZg |
|---|---|
| Name | GLOMERATOSE-B;3-O-(E)-SINAPOYL-BETA-D-FRUCTOFURANOSYL-(2->1)-[6-O-(E)-PARA-COUMAROYL]-ALPHA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H38O17 |
| InChI | InChI=1S/C32H38O17/c1-43-19-11-17(12-20(44-2)25(19)38)6-10-24(37)47-30-27(40)21(13-33)48-32(30,15-34)49-31-29(42)28(41)26(39)22(46-31)14-45-23(36)9-5-16-3-7-18(35)8-4-16/h3-12,21-22,26-31,33-35,38-42H,13-15H2,1-2H3/b9-5+,10-6+/t21-,22+,26+,27-,28-,29+,30+,31+,32+/m1/s1 |
| InChIKey | WAVHAANZAIZEDN-DIUCFGAGSA-N |
| Literature Reference Author | D.ZHANG,T.MIYASE,M.KUROYANAGI,K.UMEHARA,H.NOGUCHI |
| Literature Reference Citation | PHYTOCHEM.,47,45(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00490-1 |
| Molecular Weight | 694.644 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI4814 |