| SpectraBase Compound ID | HjD6f4NQIle |
|---|---|
| InChI | InChI=1S/C27H42O3/c1-17(15-18(29)16-28)19-9-13-27(6)21-7-8-22-24(2,3)23(30)11-12-25(22,4)20(21)10-14-26(19,27)5/h7,17,19-20,22,28H,8-16H2,1-6H3/t17-,19-,20-,22-,25+,26-,27+/m0/s1 |
| InChIKey | IPALYVZOVKJMJG-WAWRXQFFSA-N |
| Mol Weight | 414.6 g/mol |
| Molecular Formula | C27H42O3 |
| Exact Mass | 414.313395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Deluw8JmrXf |
|---|---|
| Name | TOONACILIATIN_L |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O3 |
| InChI | InChI=1S/C27H42O3/c1-17(15-18(29)16-28)19-9-13-27(6)21-7-8-22-24(2,3)23(30)11-12-25(22,4)20(21)10-14-26(19,27)5/h7,17,19-20,22,28H,8-16H2,1-6H3/t17-,19-,20-,22-,25+,26-,27+/m0/s1 |
| InChIKey | IPALYVZOVKJMJG-WAWRXQFFSA-N |
| Literature Reference Author | H.D.CHEN,S.P.YANG,Y.WU,L.DONG,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,72,685(2009) |
| Literature Reference DOI | 10.1021/np800811b |
| Molecular Weight | 414.629 g/mol |
| Sample ID | 32440 |
| Solvent | CDCl3 |