| SpectraBase Compound ID | ERgEkFa5eiF |
|---|---|
| InChI | InChI=1S/C23H39N3O3S/c1-17(9-11-23(5)19(3)15-21(27)16-20(23)4)7-6-8-18(2)10-13-30(28,29)14-12-26-22(24)25/h7,10,15,20H,6,8-9,11-14,16H2,1-5H3,(H4,24,25,26)/b17-7+,18-10+/t20-,23-/m1/s1 |
| InChIKey | QNPYTWXYLSNONB-ILGDOUQFSA-N |
| Mol Weight | 437.6 g/mol |
| Molecular Formula | C23H39N3O3S |
| Exact Mass | 437.271213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 748pRiXpmFO |
|---|---|
| Name | (+)-2-OXO-AGELASIDINE_C |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H39N3O3S |
| InChI | InChI=1S/C23H39N3O3S/c1-17(9-11-23(5)19(3)15-21(27)16-20(23)4)7-6-8-18(2)10-13-30(28,29)14-12-26-22(24)25/h7,10,15,20H,6,8-9,11-14,16H2,1-5H3,(H4,24,25,26)/b17-7+,18-10+/t20-,23-/m1/s1 |
| InChIKey | QNPYTWXYLSNONB-ILGDOUQFSA-N |
| Literature Reference Author | F.YANG,M.T.HAMANN,Y.ZOU,M.Y.ZHANG,X.B.GONG,J.R.XIAO,W.S.CHEN ,H.W.LIN |
| Literature Reference Citation | J.NAT.PROD.,75,774(2012) |
| Literature Reference DOI | 10.1021/np2009016 |
| Molecular Weight | 437.641 g/mol |
| Sample ID | 40357 |
| Solvent | CDCl3 |