![HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYLESTER](/api/spectrum/DFJBh0Qhfx8/structure.png?h=300&w=458 "HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | GCyjGWq8m8D |
|---|---|
| InChI | InChI=1S/C47H76O17/c1-22-30(51)33(54)36(57)39(61-22)63-37-34(55)32(53)26(20-60-38-35(56)31(52)25(49)19-59-38)62-40(37)64-41(58)47-16-14-42(2,3)18-24(47)23-8-9-28-43(4)12-11-29(50)44(5,21-48)27(43)10-13-46(28,7)45(23,6)15-17-47/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43?,44-,45?,46?,47-/m0/s1 |
| InChIKey | KWFQIIFLWCTDJW-JDONRVSGSA-N |
| Mol Weight | 913.1 g/mol |
| Molecular Formula | C47H76O17 |
| Exact Mass | 912.508251 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DFJBh0Qhfx8 |
|---|---|
| Name | HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O17 |
| InChI | InChI=1S/C47H76O17/c1-22-30(51)33(54)36(57)39(61-22)63-37-34(55)32(53)26(20-60-38-35(56)31(52)25(49)19-59-38)62-40(37)64-41(58)47-16-14-42(2,3)18-24(47)23-8-9-28-43(4)12-11-29(50)44(5,21-48)27(43)10-13-46(28,7)45(23,6)15-17-47/h8,22,24-40,48-57H,9-21H2,1-7H3/t22-,24-,25+,26+,27+,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,43?,44-,45?,46?,47-/m0/s1 |
| InChIKey | KWFQIIFLWCTDJW-JDONRVSGSA-N |
| Literature Reference Author | K.H.SON,K.Y.JUNG,H.W.CHANG,H.P.KIM,S.S.KANG |
| Literature Reference Citation | PHYTOCHEM.,35,1005(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90656-3 |
| Molecular Weight | 913.110 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS24416 |