| SpectraBase Compound ID | DJhYd7C4J0L |
|---|---|
| InChI | InChI=1S/C24H37NO6/c1-6-15(20(26)11-21(27)28)12-24(4)13-16(7-2)22(31-24)17(8-3)18-9-10-25(5)14-19(18)23(29)30/h9-10,14-17,20,22,26H,6-8,11-13H2,1-5H3,(H-,27,28,29,30)/t15-,16+,17+,20-,22+,24+/m1/s1 |
| InChIKey | DVEZXECTPZQDIR-LUQAVJMGSA-N |
| Mol Weight | 435.6 g/mol |
| Molecular Formula | C24H37NO6 |
| Exact Mass | 435.262088 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BlopXY0yZDi |
|---|---|
| Name | SIMPLAKIDINE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H37NO6 |
| InChI | InChI=1S/C24H37NO6/c1-6-15(20(26)11-21(27)28)12-24(4)13-16(7-2)22(31-24)17(8-3)18-9-10-25(5)14-19(18)23(29)30/h9-10,14-17,20,22,26H,6-8,11-13H2,1-5H3,(H-,27,28,29,30)/t15-,16+,17+,20-,22+,24+/m1/s1 |
| InChIKey | DVEZXECTPZQDIR-LUQAVJMGSA-N |
| Literature Reference Author | C.CAMPAGNUOLO,C.FATTORUSSO,E.FATTORUSSO,A.IANARO,B.PISANO,O. TAGLIALATELA-SCAFATI |
| Literature Reference Citation | ORG.LETTERS,5,673(2003) |
| Literature Reference DOI | 10.1021/ol027437r |
| Molecular Weight | 435.561 g/mol |
| Sample ID | 33969 |
| Solvent | CD3OD |