| SpectraBase Compound ID | KyFKaJ18IJk |
|---|---|
| InChI | InChI=1S/C37H66O8/c1-3-4-5-6-7-8-9-13-19-31(40)33-21-23-35(44-33)36-24-22-34(45-36)32(41)20-15-14-17-29(38)16-11-10-12-18-30(39)26-28-25-27(2)43-37(28)42/h25,27,29-36,38-41H,3-24,26H2,1-2H3/t27-,29+,30+,31+,32+,33-,34+,35+,36-/m0/s1 |
| InChIKey | QFFLFGFTHVFFDL-OPVULXBDSA-N |
| Mol Weight | 638.9 g/mol |
| Molecular Formula | C37H66O8 |
| Exact Mass | 638.475769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HKX2xrPqIMe |
|---|---|
| Name | PURPURACENIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H66O8 |
| InChI | InChI=1S/C37H66O8/c1-3-4-5-6-7-8-9-13-19-31(40)33-21-23-35(44-33)36-24-22-34(45-36)32(41)20-15-14-17-29(38)16-11-10-12-18-30(39)26-28-25-27(2)43-37(28)42/h25,27,29-36,38-41H,3-24,26H2,1-2H3/t27-,29+,30+,31+,32+,33-,34+,35+,36-/m0/s1 |
| InChIKey | QFFLFGFTHVFFDL-OPVULXBDSA-N |
| Literature Reference Author | D.CHAVEZ,R.MATA |
| Literature Reference Citation | PHYTOCHEM.,50,823(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00553-6 |
| Molecular Weight | 638.926 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN1443 |