| SpectraBase Compound ID | EPmuU1Ln4sY |
|---|---|
| InChI | InChI=1S/C21H32O10/c1-9-10-3-5-20(2)12(23)4-6-21(28,17(20)16(10)31-18(9)27)8-29-19-15(26)14(25)13(24)11(7-22)30-19/h10-17,19,22-26,28H,1,3-8H2,2H3/t10-,11-,12+,13-,14+,15-,16-,17+,19-,20-,21+/m0/s1 |
| InChIKey | MBUHOKDYVLBTGE-IYRAWNGUSA-N |
| Mol Weight | 444.5 g/mol |
| Molecular Formula | C21H32O10 |
| Exact Mass | 444.199547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Miu7kvmC13 |
|---|---|
| Name | IXERISOSIDE-I |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O10 |
| InChI | InChI=1S/C21H32O10/c1-9-10-3-5-20(2)12(23)4-6-21(28,17(20)16(10)31-18(9)27)8-29-19-15(26)14(25)13(24)11(7-22)30-19/h10-17,19,22-26,28H,1,3-8H2,2H3/t10-,11-,12+,13-,14+,15-,16-,17+,19-,20-,21+/m0/s1 |
| InChIKey | MBUHOKDYVLBTGE-IYRAWNGUSA-N |
| Literature Reference Author | T.WARASHINA,M.ISHINO,T.MIYASE,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,29,3217(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)80188-M |
| Molecular Weight | 444.479 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP6853 |