| SpectraBase Compound ID | EfLKA3zOa8O |
|---|---|
| InChI | InChI=1S/C23H30O11/c1-23(29)9-14(32-20(28)11-3-5-12(30-2)6-4-11)13-7-8-31-21(16(13)23)34-22-19(27)18(26)17(25)15(10-24)33-22/h3-8,13-19,21-22,24-27,29H,9-10H2,1-2H3/t13-,14+,15-,16+,17-,18+,19-,21-,22+,23-/m0/s1 |
| InChIKey | TYZRNRJFBKBHEC-ZEJZTRNDSA-N |
| Mol Weight | 482.48 g/mol |
| Molecular Formula | C23H30O11 |
| Exact Mass | 482.178812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3YiR6atW1Bs |
|---|---|
| Name | 6-O-(PARA-METHOXYBENZOYL)-AJUGOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H30O11 |
| InChI | InChI=1S/C23H30O11/c1-23(29)9-14(32-20(28)11-3-5-12(30-2)6-4-11)13-7-8-31-21(16(13)23)34-22-19(27)18(26)17(25)15(10-24)33-22/h3-8,13-19,21-22,24-27,29H,9-10H2,1-2H3/t13-,14+,15-,16+,17-,18+,19-,21-,22+,23-/m0/s1 |
| InChIKey | TYZRNRJFBKBHEC-ZEJZTRNDSA-N |
| Literature Reference Author | K.NAKANO,K.MARUYAMA,K.MURAKAMI,Y.TAKAISHI,T.TOMIMATSU |
| Literature Reference Citation | PHYTOCHEM.,32,371(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)94996-3 |
| Molecular Weight | 482.485 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS3638 |