| SpectraBase Compound ID | Gf3puNDBlXG |
|---|---|
| InChI | InChI=1S/C28H44N4O4/c1-17(2)15-22-26(33)29-14-13-20-9-11-21(12-10-20)36-25(19(5)6)24(28(35)30-22)31-27(34)23(32(7)8)16-18(3)4/h9-14,17-19,22-25H,15-16H2,1-8H3,(H,29,33)(H,30,35)(H,31,34)/b14-13-/t22-,23-,24-,25+/m0/s1 |
| InChIKey | NZSLQDJARYZBJR-GANKZJCUSA-N |
| Mol Weight | 500.7 g/mol |
| Molecular Formula | C28H44N4O4 |
| Exact Mass | 500.336256 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4TNoMXWMsZV |
|---|---|
| Name | Franganine |
| Appearance | White powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H44N4O4 |
| InChI | InChI=1S/C28H44N4O4/c1-17(2)15-22-26(33)29-14-13-20-9-11-21(12-10-20)36-25(19(5)6)24(28(35)30-22)31-27(34)23(32(7)8)16-18(3)4/h9-14,17-19,22-25H,15-16H2,1-8H3,(H,29,33)(H,30,35)(H,31,34)/b14-13-/t22-,23-,24-,25+/m0/s1 |
| InChIKey | NZSLQDJARYZBJR-GANKZJCUSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np800377y |
| Molecular Weight | 500.684 g/mol |
| Optical Rotation | [a]D20 = -302 (c = 0.1 CHCl3) |
| SMILES | N1C([C@](CC(C)C)(NC([C@]([C@](Oc2ccc(\C=C/1)cc2)(C(C)C)[H])(NC(=O)[C@](CC(C)C)(N(C)C)[H])[H])=O)[H])=O |
| SPLASH | splash10-03di-0900000000-6e5ec140d5b7790bc81b |
| Source of Spectrum | G4-72-SM3-1 |
| Wiley ID | 1872160 |