| SpectraBase Compound ID | 6olWZqDoInf |
|---|---|
| InChI | InChI=1S/C40H64O12/c1-20(2)14-21-15-38(7,52-34-31(46)29(44)24(42)17-48-34)32-22-8-9-26-36(5)12-11-27(50-33-30(45)28(43)23(41)16-47-33)35(3,4)25(36)10-13-37(26,6)39(22)18-40(32,51-21)49-19-39/h14,21-34,41-46H,8-13,15-19H2,1-7H3/t21?,22?,23-,24-,25?,26?,27?,28-,29-,30+,31+,32?,33-,34-,36-,37+,38-,39-,40-/m0/s1 |
| InChIKey | AGYKYCQDUUPCBZ-ZSJWUOFNSA-N |
| Mol Weight | 736.9 g/mol |
| Molecular Formula | C40H64O12 |
| Exact Mass | 736.439777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9741TGYMAsI |
|---|---|
| Name | BACOPASAPONIN-A;3-O-ALPHA-L-ARABINOPYRANOSYL-20-O-ALPHA-L-ARABINOPYRANOSYL-JUJUBOGENIN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H64O12 |
| InChI | InChI=1S/C40H64O12/c1-20(2)14-21-15-38(7,52-34-31(46)29(44)24(42)17-48-34)32-22-8-9-26-36(5)12-11-27(50-33-30(45)28(43)23(41)16-47-33)35(3,4)25(36)10-13-37(26,6)39(22)18-40(32,51-21)49-19-39/h14,21-34,41-46H,8-13,15-19H2,1-7H3/t21?,22?,23-,24-,25?,26?,27?,28-,29-,30+,31+,32?,33-,34-,36-,37+,38-,39-,40-/m0/s1 |
| InChIKey | AGYKYCQDUUPCBZ-ZSJWUOFNSA-N |
| Literature Reference Author | S.GARAI,S.B.MAHATO,K.OHTANI,K.YAMASAKI |
| Literature Reference Citation | PHYTOCHEM.,42,815(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00936-1 |
| Molecular Weight | 736.941 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU3604 |