| SpectraBase Compound ID | DVfff2sgyAQ |
|---|---|
| InChI | InChI=1S/C20H22O7/c1-6-9(2)18(23)26-16-15-11(4)19(24)25-13(15)7-10(3)12-8-14(21)20(5,27-12)17(16)22/h6-8,13,15-17,22H,4H2,1-3,5H3/b9-6+,10-7-/t13-,15+,16+,17+,20+/m1/s1 |
| InChIKey | GDZUNXYZSHAMFN-XABIGMOASA-N |
| Mol Weight | 374.39 g/mol |
| Molecular Formula | C20H22O7 |
| Exact Mass | 374.136553 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4bjIDRPDH0o |
|---|---|
| Name | 11(13)-EN-9-BETA-HYDROXY-ATRIPLICIOLIDE-8-O-TIGLATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H22O7 |
| InChI | InChI=1S/C20H22O7/c1-6-9(2)18(23)26-16-15-11(4)19(24)25-13(15)7-10(3)12-8-14(21)20(5,27-12)17(16)22/h6-8,13,15-17,22H,4H2,1-3,5H3/b9-6+,10-7-/t13-,15+,16+,17+,20+/m1/s1 |
| InChIKey | GDZUNXYZSHAMFN-XABIGMOASA-N |
| Literature Reference Author | T.MORGENSTERN,R.M.KING,J.JAKUPOVIC |
| Literature Reference Citation | PHYTOCHEM.,41,1543(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00806-3 |
| Molecular Weight | 374.390 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU4451 |