| SpectraBase Compound ID | Ji4dyd57bMS |
|---|---|
| InChI | InChI=1S/C27H43NO2/c1-19(2)10-9-12-21(4)24-13-14-25-23(18-26(29)30)22(15-16-27(24,25)5)20(3)11-7-6-8-17-28/h6,8,19,21-25H,3,7,9-16,18H2,1-2,4-5H3,(H,29,30)/b8-6-/t21-,22-,23-,24-,25+,27-/m1/s1 |
| InChIKey | LCEQNNMEJGUMMF-NNJPKAKUSA-N |
| Mol Weight | 413.6 g/mol |
| Molecular Formula | C27H43NO2 |
| Exact Mass | 413.32938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HBxQPwPWezY |
|---|---|
| Name | LCEQNNMEJGUMMF-NNJPKAKUSA-N |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H43NO2 |
| InChI | InChI=1S/C27H43NO2/c1-19(2)10-9-12-21(4)24-13-14-25-23(18-26(29)30)22(15-16-27(24,25)5)20(3)11-7-6-8-17-28/h6,8,19,21-25H,3,7,9-16,18H2,1-2,4-5H3,(H,29,30)/b8-6-/t21-,22-,23-,24-,25+,27-/m1/s1 |
| InChIKey | LCEQNNMEJGUMMF-NNJPKAKUSA-N |
| Literature Reference Author | H.PENG,W.XIE,D.M.OTTERNESS,J.P.COGSWELL,R.T.M.CONNELL,H.L.CA RTER,G.POWIS,R.T.ABR |
| Literature Reference Citation | J.MED.CHEM.,44,834(2001) |
| Literature Reference DOI | 10.1021/jm0004401 |
| Molecular Weight | 413.644 g/mol |
| Sample ID | 40871 |
| Solvent | CDCl3 |