| SpectraBase Compound ID | BU9Rok4Hl2a |
|---|---|
| InChI | InChI=1S/C17H26O7/c1-8-6-10(24-9(2)18)12-15(3,4)7-16(5,14(21)22)17(12,23)11(8)13(19)20/h8,10-12,23H,6-7H2,1-5H3,(H,19,20)(H,21,22)/t8-,10+,11-,12+,16-,17-/m1/s1 |
| InChIKey | SBTMGXIFRALHDM-VRUKSGGOSA-N |
| Mol Weight | 342.39 g/mol |
| Molecular Formula | C17H26O7 |
| Exact Mass | 342.167853 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LoKaw62P0E2 |
|---|---|
| Name | BOTRYDIOIC-ACID |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H26O7 |
| InChI | InChI=1S/C17H26O7/c1-8-6-10(24-9(2)18)12-15(3,4)7-16(5,14(21)22)17(12,23)11(8)13(19)20/h8,10-12,23H,6-7H2,1-5H3,(H,19,20)(H,21,22)/t8-,10+,11-,12+,16-,17-/m1/s1 |
| InChIKey | SBTMGXIFRALHDM-VRUKSGGOSA-N |
| Literature Reference Author | J.L.REINO,R.DURAN-PATRON,I.SEGURA,R.HERNANDEZ-GALAN,H.H.RIES E,I.G.COLLADO |
| Literature Reference Citation | J.NAT.PROD.,66,344(2003) |
| Literature Reference DOI | 10.1021/np020392i |
| Molecular Weight | 342.389 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI4596 |