| SpectraBase Compound ID | I2ER3PXNa2p |
|---|---|
| InChI | InChI=1S/C48H74O19/c1-43(2)16-18-48(42(59)67-39-32(53)31(52)30(51)25(21-49)63-39)19-17-46(6)23(24(48)20-43)10-11-27-45(5)14-13-28(44(3,4)26(45)12-15-47(27,46)7)64-40-34(55)35(33(54)36(66-40)37(56)57)65-41(38(58)61-9)62-22-29(50)60-8/h10,24-28,30-36,39-41,49,51-55H,11-22H2,1-9H3,(H,56,57) |
| InChIKey | GRYXKVCXNLLBSZ-UHFFFAOYSA-N |
| Mol Weight | 955.1 g/mol |
| Molecular Formula | C48H74O19 |
| Exact Mass | 954.48243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G19Hn5xtHFj |
|---|---|
| Name | ACHYRANTHOSIDE_E_DIMETHYLESTER |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H74O19 |
| InChI | InChI=1S/C48H74O19/c1-43(2)16-18-48(42(59)67-39-32(53)31(52)30(51)25(21-49)63-39)19-17-46(6)23(24(48)20-43)10-11-27-45(5)14-13-28(44(3,4)26(45)12-15-47(27,46)7)64-40-34(55)35(33(54)36(66-40)37(56)57)65-41(38(58)61-9)62-22-29(50)60-8/h10,24-28,30-36,39-41,49,51-55H,11-22H2,1-9H3,(H,56,57) |
| InChIKey | GRYXKVCXNLLBSZ-UHFFFAOYSA-N |
| Literature Reference Author | J.X.LI,T.HAREYAMA,Y.TEZUKA,Y.ZHANG,T.MIYAHARA,S.KADOTA |
| Literature Reference Citation | PLANTA.MED.,71,673(2005) |
| Literature Reference DOI | 10.1055/s-2005-871275 |
| Molecular Weight | 955.104 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ47014 |