| SpectraBase Compound ID | 3n6Cb1tpLnl |
|---|---|
| InChI | InChI=1S/C44H76O4/c1-10-11-12-13-14-15-16-17-18-19-20-21-38(47)48-37-25-26-41(6)34(40(37,4)5)24-27-43(8)35(41)23-22-32-39-31(3)30(2)33(45)28-42(39,7)36(46)29-44(32,43)9/h31-37,39,45-46H,2,10-29H2,1,3-9H3 |
| InChIKey | CXMGKRUBYRYKDR-UHFFFAOYSA-N |
| Mol Weight | 669.1 g/mol |
| Molecular Formula | C44H76O4 |
| Exact Mass | 668.574361 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DGFPs3L77Cs |
|---|---|
| Name | ARNITRIOL_A_3-MYRISTATE |
| Compound Number | 6B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H76O4 |
| InChI | InChI=1S/C44H76O4/c1-10-11-12-13-14-15-16-17-18-19-20-21-38(47)48-37-25-26-41(6)34(40(37,4)5)24-27-43(8)35(41)23-22-32-39-31(3)30(2)33(45)28-42(39,7)36(46)29-44(32,43)9/h31-37,39,45-46H,2,10-29H2,1,3-9H3 |
| InChIKey | CXMGKRUBYRYKDR-UHFFFAOYSA-N |
| Literature Reference Author | T.J.SCHMIDT,J.VONRAISON,G.WILLUHN |
| Literature Reference Citation | PLANTA.MED.,70,967(2004) |
| Literature Reference DOI | 10.1055/s-2004-832624 |
| Molecular Weight | 669.085 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ48487 |