| SpectraBase Compound ID | 3W4tbaBZRst |
|---|---|
| InChI | InChI=1S/C28H45NO5S/c1-4-5-6-7-8-11-16-32-28(25-20-35-27(31)29-25)19-24-18-23(34-28)15-14-21(2)12-9-10-13-22(3)17-26(30)33-24/h9,12,17,21,23-25H,4-8,10-11,13-16,18-20H2,1-3H3,(H,29,31)/b12-9-,22-17-/t21?,23-,24-,25-,28-/m0/s1 |
| InChIKey | VZIJRUYGPMQTFM-CODSDJRZSA-N |
| Mol Weight | 507.7 g/mol |
| Molecular Formula | C28H45NO5S |
| Exact Mass | 507.301845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kq7uypoWndY |
|---|---|
| Name | 15-O-OCTYLLATRUNCULIN_B |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H45NO5S |
| InChI | InChI=1S/C28H45NO5S/c1-4-5-6-7-8-11-16-32-28(25-20-35-27(31)29-25)19-24-18-23(34-28)15-14-21(2)12-9-10-13-22(3)17-26(30)33-24/h9,12,17,21,23-25H,4-8,10-11,13-16,18-20H2,1-3H3,(H,29,31)/b12-9-,22-17-/t21?,23-,24-,25-,28-/m0/s1 |
| InChIKey | VZIJRUYGPMQTFM-CODSDJRZSA-N |
| Literature Reference Author | K.A.ELSAYED,D.T.A.YOUSSEF,D.MARCHETTI |
| Literature Reference Citation | J.NAT.PROD.,69,219(2006) |
| Literature Reference DOI | 10.1021/np050372r |
| Molecular Weight | 507.729 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ17006 |