| SpectraBase Compound ID | 8awN1jG80SR |
|---|---|
| InChI | InChI=1S/C42H66O14/c1-37(2)14-16-42(36(52)56-34-30(48)27(45)26(44)22(19-43)53-34)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-31(49)28(46)29(47)32(55-35)33(50)51/h8,21-32,34-35,43-49H,9-19H2,1-7H3,(H,50,51)/t21?,22?,23?,24?,25?,26?,27?,28-,29+,30?,31-,32+,34?,35+,39?,40?,41?,42?/m1/s1 |
| InChIKey | YOSRLTNUOCHBEA-UHXISHDFSA-N |
| Mol Weight | 795.0 g/mol |
| Molecular Formula | C42H66O14 |
| Exact Mass | 794.445257 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5StpxDNGaqU |
|---|---|
| Name | Chikusetsaponin iv-A |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C42H66O14 |
| InChI | InChI=1S/C42H66O14/c1-37(2)14-16-42(36(52)56-34-30(48)27(45)26(44)22(19-43)53-34)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-31(49)28(46)29(47)32(55-35)33(50)51/h8,21-32,34-35,43-49H,9-19H2,1-7H3,(H,50,51)/t21?,22?,23?,24?,25?,26?,27?,28-,29+,30?,31-,32+,34?,35+,39?,40?,41?,42?/m1/s1 |
| InChIKey | YOSRLTNUOCHBEA-UHXISHDFSA-N |
| Instrument Name | Jeol PFT-100 |
| Literature Reference | R.L. Nie, T. Morita, Planta Medica 50, 322 (1984). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |