| SpectraBase Compound ID | LrdAmDWaAos |
|---|---|
| InChI | InChI=1S/C27H44O7/c1-14(2)6-7-22(32)26(5,33)21-8-9-27(34)16-11-17(28)15-10-18(29)19(30)12-24(15,3)23(16)20(31)13-25(21,27)4/h11,14-15,18-23,29-34H,6-10,12-13H2,1-5H3/t15-,18+,19-,20+,21-,22+,23+,24-,25+,26?,27+/m0/s1 |
| InChIKey | LQGNCUXDDPRDJH-WRLHHJGSSA-N |
| Mol Weight | 480.6 g/mol |
| Molecular Formula | C27H44O7 |
| Exact Mass | 480.308704 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8yZqkCS5z7m |
|---|---|
| Name | AJUGASTERONE-C |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O7 |
| InChI | InChI=1S/C27H44O7/c1-14(2)6-7-22(32)26(5,33)21-8-9-27(34)16-11-17(28)15-10-18(29)19(30)12-24(15,3)23(16)20(31)13-25(21,27)4/h11,14-15,18-23,29-34H,6-10,12-13H2,1-5H3/t15-,18+,19-,20+,21-,22+,23+,24-,25+,26?,27+/m0/s1 |
| InChIKey | LQGNCUXDDPRDJH-WRLHHJGSSA-N |
| Literature Reference Author | V.N.ODINOKOV,I.V.GALYAUTDINOV,D.V.NEDOPEKIN,L.M.KHALILOV,A.S .SHASHKOV,V.V.KACHAL |
| Literature Reference Citation | INS.BIO.MOL.BIOL.,32,161(2002) |
| Literature Reference DOI | 10.1016/s0965-1748(01)00106-0 |
| Molecular Weight | 480.642 g/mol |
| Source File Reference | UWLU75087 |