| SpectraBase Compound ID | B6HuUZLsUOX |
|---|---|
| InChI | InChI=1S/C26H39NO3/c1-7-16(2)15-27-20-13-21(28)24(30)19(23(20)29)14-26(6)18(4)11-12-25(5)17(3)9-8-10-22(25)26/h13,16,18,22,27,30H,3,7-12,14-15H2,1-2,4-6H3/t16-,18-,22+,25+,26+/m0/s1 |
| InChIKey | OQBIQYAAYLIDNT-AZDFDGHFSA-N |
| Mol Weight | 413.6 g/mol |
| Molecular Formula | C26H39NO3 |
| Exact Mass | 413.292994 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7UoTQbI0w91 |
|---|---|
| Name | Nakijiquinone L |
| Appearance | Purple-red amorphous solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H39NO3 |
| InChI | InChI=1S/C26H39NO3/c1-7-16(2)15-27-20-13-21(28)24(30)19(23(20)29)14-26(6)18(4)11-12-25(5)17(3)9-8-10-22(25)26/h13,16,18,22,27,30H,3,7-12,14-15H2,1-2,4-6H3/t16-,18-,22+,25+,26+/m0/s1 |
| InChIKey | OQBIQYAAYLIDNT-AZDFDGHFSA-N |
| Instrument Name | JEOL FABmate |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np900470e |
| Molecular Weight | 413.602 g/mol |
| Optical Rotation | [a]D22 = +33 (c = 0.2, CHCl3) |
| Reported Formula | C26H39NO3 |
| SMILES | OC1=C(C(C(=CC1=O)NC[C@](CC)(C)[H])=O)C[C@]1([C@@]2(CCCC([C@]2(CC[C@@]1(C)[H])C)=C)[H])C |
| SPLASH | splash10-00di-0290100000-c1910ea270e1c06b2f4f |
| Source of Spectrum | G4-73-470-3 |
| Wiley ID | 1848922 |