| SpectraBase Compound ID | K6edVBORmzk |
|---|---|
| InChI | InChI=1S/C26H32N2O8/c1-3-19(2)24(26(35)36)28-22(30)17-15-13-11-9-7-5-4-6-8-10-12-14-16-21(29)27-20(25(33)34)18-23(31)32/h4-17,19-20,24H,3,18H2,1-2H3,(H,27,29)(H,28,30)(H,31,32)(H,33,34)(H,35,36)/b5-4+,8-6+,9-7+,12-10+,13-11+,16-14+,17-15+/t19-,20+,24-/m0/s1 |
| InChIKey | OTBWMESMPGYGIA-KQYYGSRXSA-N |
| Mol Weight | 500.5 g/mol |
| Molecular Formula | C26H32N2O8 |
| Exact Mass | 500.215866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7YXI7Xt9fSP |
|---|---|
| Name | BOLETOCROCIN-A |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H32N2O8 |
| InChI | InChI=1S/C26H32N2O8/c1-3-19(2)24(26(35)36)28-22(30)17-15-13-11-9-7-5-4-6-8-10-12-14-16-21(29)27-20(25(33)34)18-23(31)32/h4-17,19-20,24H,3,18H2,1-2H3,(H,27,29)(H,28,30)(H,31,32)(H,33,34)(H,35,36)/b5-4+,8-6+,9-7+,12-10+,13-11+,16-14+,17-15+/t19-,20+,24-/m0/s1 |
| InChIKey | OTBWMESMPGYGIA-KQYYGSRXSA-N |
| Literature Reference Author | L.KAHNER,J.DASENBROCK,P.SPITELLER,W.STEGLICH,R.MARUMOTO,M.SP ITELLER |
| Literature Reference Citation | PHYTOCHEM.,49,1693(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00319-7 |
| Molecular Weight | 500.549 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU645 |