![#11;SAPONIN-6;3-O-[BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSY](/api/spectrum/GrcRihGFQ5u/structure.png?h=300&w=458 "#11;SAPONIN-6;3-O-[BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSY")
| SpectraBase Compound ID | 5qHJB22by4G |
|---|---|
| InChI | InChI=1S/C56H92O27/c1-21-7-12-56(73-19-21)22(2)34-29(83-56)14-27-25-6-5-23-13-24(8-10-54(23,3)26(25)9-11-55(27,34)4)74-50-43(70)39(66)46(33(18-60)77-50)80-53-48(82-51-42(69)38(65)36(63)30(15-57)75-51)47(37(64)31(16-58)76-53)81-52-44(71)40(67)45(32(17-59)78-52)79-49-41(68)35(62)28(61)20-72-49/h21-53,57-71H,5-20H2,1-4H3/t21-,22-,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+,51+,52-,53+,54-,55-,56-/m0/s1 |
| InChIKey | FKSKHGFCGBTEGN-GIJLGWETSA-N |
| Mol Weight | 1197.3 g/mol |
| Molecular Formula | C56H92O27 |
| Exact Mass | 1196.582598 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GrcRihGFQ5u |
|---|---|
| Name | #11;SAPONIN-6;3-O-[BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSY |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H92O27 |
| InChI | InChI=1S/C56H92O27/c1-21-7-12-56(73-19-21)22(2)34-29(83-56)14-27-25-6-5-23-13-24(8-10-54(23,3)26(25)9-11-55(27,34)4)74-50-43(70)39(66)46(33(18-60)77-50)80-53-48(82-51-42(69)38(65)36(63)30(15-57)75-51)47(37(64)31(16-58)76-53)81-52-44(71)40(67)45(32(17-59)78-52)79-49-41(68)35(62)28(61)20-72-49/h21-53,57-71H,5-20H2,1-4H3/t21-,22-,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+,51+,52-,53+,54-,55-,56-/m0/s1 |
| InChIKey | FKSKHGFCGBTEGN-GIJLGWETSA-N |
| Literature Reference Author | H.ACHENBACH,H.HUEBNER,W.BRANDT,M.REITER |
| Literature Reference Citation | PHYTOCHEM.,35,1527(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)86890-9 |
| Molecular Weight | 1197.330 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU25293 |