| SpectraBase Compound ID | 8wbwlOf2n3X |
|---|---|
| InChI | InChI=1S/C28H41NO3/c1-25(19-13-11-17-23-32-27-20-14-10-15-21-27)18-12-8-6-4-3-5-7-9-16-22-28(31)29-26(2)24-30/h4-7,10,12-15,18-21,25-26,30H,3,8-9,11,16-17,22-24H2,1-2H3,(H,29,31)/b6-4-,7-5-,18-12-,19-13-/t25-,26-/m1/s1 |
| InChIKey | QJWJOWYBUFPMFV-WFEQAXAMSA-N |
| Mol Weight | 439.6 g/mol |
| Molecular Formula | C28H41NO3 |
| Exact Mass | 439.308644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D6hBxCdU7fr |
|---|---|
| Name | (13S,5Z,8Z,11Z,14Z)-N-((R)-1-Hydroxypropan-2-yl)-13-methyl-18-phenoxyoctadeca-5,8,11,14-tetraenamide |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H41NO3 |
| InChI | InChI=1S/C28H41NO3/c1-25(19-13-11-17-23-32-27-20-14-10-15-21-27)18-12-8-6-4-3-5-7-9-16-22-28(31)29-26(2)24-30/h4-7,10,12-15,18-21,25-26,30H,3,8-9,11,16-17,22-24H2,1-2H3,(H,29,31)/b6-4-,7-5-,18-12-,19-13-/t25-,26-/m1/s1 |
| InChIKey | QJWJOWYBUFPMFV-WFEQAXAMSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/acs.jmedchem.8b00611 |
| Molecular Weight | 439.640 g/mol |
| SMILES | OC[C@@](C)(NC(CCC\C=C/C\C=C/C\C=C/[C@](\C=C/CCCOc1ccccc1)(C)[H])=O)[H] |
| SPLASH | splash10-0002-8911200000-50f5faa2629a5852e49e |
| Source of Spectrum | AF-61-8651-3b |
| Wiley ID | 1870154 |