| SpectraBase Compound ID | LmyYbUjFvAU |
|---|---|
| InChI | InChI=1S/C68H118O2/c1-56(2)59(6)50-52-62(9)61(8)49-48-58(5)44-43-47-66-68(12,55-54-64(11)63(10)53-51-60(7)57(3)4)70-67(69-66)65-45-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-46-65/h25-28,44-45,59-61,64,66-67H,1,3,9-10,13-24,29-43,46-55H2,2,4-8,11-12H3/b27-25-,28-26-,58-44+,65-45+/t59?,60?,61?,64?,66-,67-,68-/m1/s1 |
| InChIKey | QFSRCHDEMCBBLY-BCKRSOIVSA-N |
| Mol Weight | 967.7 g/mol |
| Molecular Formula | C68H118O2 |
| Exact Mass | 966.913183 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EFhDBQDg6hf |
|---|---|
| Name | QFSRCHDEMCBBLY-BCKRSOIVSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H118O2 |
| InChI | InChI=1S/C68H118O2/c1-56(2)59(6)50-52-62(9)61(8)49-48-58(5)44-43-47-66-68(12,55-54-64(11)63(10)53-51-60(7)57(3)4)70-67(69-66)65-45-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-46-65/h25-28,44-45,59-61,64,66-67H,1,3,9-10,13-24,29-43,46-55H2,2,4-8,11-12H3/b27-25-,28-26-,58-44+,65-45+/t59?,60?,61?,64?,66-,67-,68-/m1/s1 |
| InChIKey | QFSRCHDEMCBBLY-BCKRSOIVSA-N |
| Literature Reference Author | P.METZGER,M.N.RAGER,C.FOSSE |
| Literature Reference Citation | PHYTOCHEM.,69,2380(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.06.004 |
| Molecular Weight | 967.684 g/mol |
| Sample ID | 63771 |
| Solvent | CDCl3 |