| SpectraBase Compound ID | GOuPFSfOWxC |
|---|---|
| InChI | InChI=1S/C27H37NO4/c1-6-16(2)13-17(3)14-19(5)26-18(4)7-12-23(32-26)24-25(30)22(15-28-27(24)31)20-8-10-21(29)11-9-20/h8-11,14-18,23,26,29H,6-7,12-13H2,1-5H3,(H2,28,30,31)/b19-14+/t16?,17?,18-,23+,26-/m1/s1 |
| InChIKey | YDGOHTBOOYAVOP-JRVIKJEFSA-N |
| Mol Weight | 439.6 g/mol |
| Molecular Formula | C27H37NO4 |
| Exact Mass | 439.272259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 46tkkBI38G3 |
|---|---|
| Name | N-DEMETHYLSAMBUTOXIN |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H37NO4 |
| InChI | InChI=1S/C27H37NO4/c1-6-16(2)13-17(3)14-19(5)26-18(4)7-12-23(32-26)24-25(30)22(15-28-27(24)31)20-8-10-21(29)11-9-20/h8-11,14-18,23,26,29H,6-7,12-13H2,1-5H3,(H2,28,30,31)/b19-14+/t16?,17?,18-,23+,26-/m1/s1 |
| InChIKey | YDGOHTBOOYAVOP-JRVIKJEFSA-N |
| Literature Reference Author | L.JAYASINGHE,H.K.ABBAS,M.R.JACOB,W.H.W.HERATH,N.P.D.NANAYAKK ARA |
| Literature Reference Citation | J.NAT.PROD.,69,439(2006) |
| Literature Reference DOI | 10.1021/np050487v |
| Molecular Weight | 439.595 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ18118 |