| SpectraBase Compound ID | JbUqohGyLzR |
|---|---|
| InChI | InChI=1S/C28H38O9S/c1-15-8-10-19(11-9-15)38(31,32)37-22-24(35-17(3)29)26(5,6)21-20-16(2)14-28(33-12-13-34-28)23(21)27(20,7)25(22)36-18(4)30/h8-11,16,20-25H,12-14H2,1-7H3/t16-,20+,21+,22-,23-,24-,25-,27-/m1/s1 |
| InChIKey | JKRKDNKTFJKBRE-PCMKKSRKSA-N |
| Mol Weight | 550.7 g/mol |
| Molecular Formula | C28H38O9S |
| Exact Mass | 550.223654 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I2x2u80mcnr |
|---|---|
| Name | LONGIPINANTRIOLONE-3,5-DIACETATE-4-TOSYLATE-9-ETHYLENEKETAL |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O9S |
| InChI | InChI=1S/C28H38O9S/c1-15-8-10-19(11-9-15)38(31,32)37-22-24(35-17(3)29)26(5,6)21-20-16(2)14-28(33-12-13-34-28)23(21)27(20,7)25(22)36-18(4)30/h8-11,16,20-25H,12-14H2,1-7H3/t16-,20+,21+,22-,23-,24-,25-,27-/m1/s1 |
| InChIKey | JKRKDNKTFJKBRE-PCMKKSRKSA-N |
| Literature Reference Author | L.U.ROMAN,J.D.HERNANDEZ,C.M.CERDA-GARCIA-ROJAS,R.M.DOMINGUEZ -LOPEZ,P.JOSEPH-NATH |
| Literature Reference Citation | J.NAT.PROD.,55,577(1992) |
| Literature Reference DOI | 10.1021/np50083a004 |
| Molecular Weight | 550.664 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS4293 |