| SpectraBase Compound ID | GJn3eHtIoHA |
|---|---|
| InChI | InChI=1S/C21H32O14/c1-20(29)3-2-8-9(16(27)28)5-31-17(11(8)20)35-18-14(13(25)12(24)10(4-22)33-18)34-19-15(26)21(30,6-23)7-32-19/h5,8,10-15,17-19,22-26,29-30H,2-4,6-7H2,1H3,(H,27,28)/t8?,10-,11?,12-,13+,14-,15+,17-,18+,19-,20-,21-/m1/s1 |
| InChIKey | AMVJBPWDFCUNOH-WTPIWKDRSA-N |
| Mol Weight | 508.5 g/mol |
| Molecular Formula | C21H32O14 |
| Exact Mass | 508.179206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3osKl7H3ya1 |
|---|---|
| Name | INERMINOSIDE-A1;2'-O-(BETA-D-APOIFURANOSYL)-MUSSAENOSIDIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O14 |
| InChI | InChI=1S/C21H32O14/c1-20(29)3-2-8-9(16(27)28)5-31-17(11(8)20)35-18-14(13(25)12(24)10(4-22)33-18)34-19-15(26)21(30,6-23)7-32-19/h5,8,10-15,17-19,22-26,29-30H,2-4,6-7H2,1H3,(H,27,28)/t8?,10-,11?,12-,13+,14-,15+,17-,18+,19-,20-,21-/m1/s1 |
| InChIKey | AMVJBPWDFCUNOH-WTPIWKDRSA-N |
| Literature Reference Author | I.CALIS,M.HOSNY,A.YUERUEKER |
| Literature Reference Citation | PHYTOCHEM.,37,1083(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89533-3 |
| Molecular Weight | 508.477 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU23601 |