![FALLAXOSE-B;3-O-[4-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-(2-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYL]-FERULOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-(4,6-DI-O-BENZOYL)](/api/spectrum/AIuQt5CPTk2/structure.png?h=300&w=458 "FALLAXOSE-B;3-O-[4-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-(2-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYL]-FERULOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-(4,6-DI-O-BENZOYL)")
| SpectraBase Compound ID | JF92L8yLX9y |
|---|---|
| InChI | InChI=1S/C50H60O26/c1-23-34(56)42(74-47-39(61)37(59)35(57)30(19-51)70-47)43(68-24(2)54)49(67-23)69-28-16-14-25(18-29(28)65-3)15-17-33(55)72-44-36(58)31(20-52)75-50(44,22-53)76-48-40(62)38(60)41(73-46(64)27-12-8-5-9-13-27)32(71-48)21-66-45(63)26-10-6-4-7-11-26/h4-18,23,30-32,34-44,47-49,51-53,56-62H,19-22H2,1-3H3/b17-15+/t23-,30+,31-,32+,34-,35+,36-,37-,38+,39+,40+,41+,42+,43+,44+,47-,48+,49-,50+/m1/s1 |
| InChIKey | ARMVYDQAOZQHJB-JLZSBRGWSA-N |
| Mol Weight | 1077.0 g/mol |
| Molecular Formula | C50H60O26 |
| Exact Mass | 1076.337282 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AIuQt5CPTk2 |
|---|---|
| Name | FALLAXOSE-B;3-O-[4-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-(2-O-ACETYL)-ALPHA-L-RHAMNOPYRANOSYL]-FERULOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-(4,6-DI-O-BENZOYL) |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H60O26 |
| InChI | InChI=1S/C50H60O26/c1-23-34(56)42(74-47-39(61)37(59)35(57)30(19-51)70-47)43(68-24(2)54)49(67-23)69-28-16-14-25(18-29(28)65-3)15-17-33(55)72-44-36(58)31(20-52)75-50(44,22-53)76-48-40(62)38(60)41(73-46(64)27-12-8-5-9-13-27)32(71-48)21-66-45(63)26-10-6-4-7-11-26/h4-18,23,30-32,34-44,47-49,51-53,56-62H,19-22H2,1-3H3/b17-15+/t23-,30+,31-,32+,34-,35+,36-,37-,38+,39+,40+,41+,42+,43+,44+,47-,48+,49-,50+/m1/s1 |
| InChIKey | ARMVYDQAOZQHJB-JLZSBRGWSA-N |
| Literature Reference Author | D.ZHANG,T.MIYASE,M.KUROYANAGI,K.UMEHARA,H.NOGUCHI |
| Literature Reference Citation | PHYTOCHEM.,45,733(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00065-4 |
| Molecular Weight | 1077.011 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSP1526 |