| SpectraBase Compound ID | IwEOQG3OT3n |
|---|---|
| InChI | InChI=1S/C22H26O8/c1-9-7-14(25)16-10(2)8-15(28-20(26)11(3)12(4)23)18-19(17(9)16)29-21(27)22(18,6)30-13(5)24/h7,12,15,17-19,23H,3,8H2,1-2,4-6H3/t12?,15-,17+,18+,19-,22-/m0/s1 |
| InChIKey | MEGAIYLFOJKEBX-ZFBOBNNHSA-N |
| Mol Weight | 418.44 g/mol |
| Molecular Formula | C22H26O8 |
| Exact Mass | 418.162768 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Bd2nhKtY0qv |
|---|---|
| Name | Ferupennin G |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26O8 |
| InChI | InChI=1S/C22H26O8/c1-9-7-14(25)16-10(2)8-15(28-20(26)11(3)12(4)23)18-19(17(9)16)29-21(27)22(18,6)30-13(5)24/h7,12,15,17-19,23H,3,8H2,1-2,4-6H3/t12?,15-,17+,18+,19-,22-/m0/s1 |
| InChIKey | MEGAIYLFOJKEBX-ZFBOBNNHSA-N |
| Instrument Name | JEOL JMSD-300 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np020014d |
| Molecular Weight | 418.442 g/mol |
| Optical Rotation | [a]D = +5.0 (c = 1.0, CHCl3) |
| Reported Formula | C22H26O8 |
| SMILES | OC(C(C(O[C@@]1([C@@]2([C@]([C@]3(C(=C(C1)C)C(C=C3C)=O)[H])(OC([C@]2(OC(=O)C)C)=O)[H])[H])[H])=O)=C)C |
| SPLASH | splash10-0rs4-6941100000-42ad5f1f4db87c098eed |
| Source of Spectrum | G4-65-1901-7 |
| Wiley ID | 1883535 |