| SpectraBase Compound ID | Ev4ngrrujJU |
|---|---|
| InChI | InChI=1S/C22H34O7/c1-13-7-8-16-21(2,3)9-6-10-22(16,4)15(13)12-29-18(19(25)26)14(11-17(23)24)20(27)28-5/h14-16,18H,1,6-12H2,2-5H3,(H,23,24)(H,25,26)/t14-,15+,16?,18+,22-/m1/s1 |
| InChIKey | IYZRYEITHZQKJK-MRJNPBFDSA-N |
| Mol Weight | 410.5 g/mol |
| Molecular Formula | C22H34O7 |
| Exact Mass | 410.230453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | iUblriHE9F |
|---|---|
| Name | 2''-O-METHYL-CRYPTOPORIC-ACID-H |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H34O7 |
| InChI | InChI=1S/C22H34O7/c1-13-7-8-16-21(2,3)9-6-10-22(16,4)15(13)12-29-18(19(25)26)14(11-17(23)24)20(27)28-5/h14-16,18H,1,6-12H2,2-5H3,(H,23,24)(H,25,26)/t14-,15+,16?,18+,22-/m1/s1 |
| InChIKey | IYZRYEITHZQKJK-MRJNPBFDSA-N |
| Literature Reference Author | G.M.CABRERA,M.J.ROBERTI,J.E.WRIGHT,A.M.SELDES |
| Literature Reference Citation | PHYTOCHEM.,61,189(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00221-2 |
| Molecular Weight | 410.508 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU29337 |