| SpectraBase Compound ID | 8IGcV9W08RC |
|---|---|
| InChI | InChI=1S/C35H52O5/c1-21(2)13-12-17-33(11)25(15-14-22(3)4)20-34(18-16-23(5)6)30-26(19-27(40-30)32(9,10)39)29(37)35(33,31(34)38)28(36)24(7)8/h13-14,16,24-25,27,39H,12,15,17-20H2,1-11H3/t25-,27?,33+,34+,35-/m0/s1 |
| InChIKey | MGDKDTTZQJLKED-NBAKNEFJSA-N |
| Mol Weight | 552.8 g/mol |
| Molecular Formula | C35H52O5 |
| Exact Mass | 552.381475 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5uI3VWprUW4 |
|---|---|
| Name | FUROHYPERFORIN;ISOMER-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H52O5 |
| InChI | InChI=1S/C35H52O5/c1-21(2)13-12-17-33(11)25(15-14-22(3)4)20-34(18-16-23(5)6)30-26(19-27(40-30)32(9,10)39)29(37)35(33,31(34)38)28(36)24(7)8/h13-14,16,24-25,27,39H,12,15,17-20H2,1-11H3/t25-,27?,33+,34+,35-/m0/s1 |
| InChIKey | MGDKDTTZQJLKED-NBAKNEFJSA-N |
| Literature Reference Author | J.Y.LEE,R.K.DUKE,V.H.TRAN,J.M.HOOK,C.C.DUKE |
| Literature Reference Citation | PHYTOCHEM.,67,2550(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.09.018 |
| Molecular Weight | 552.795 g/mol |
| Sample ID | 67126 |
| Solvent | CDCl3 |